Chapter 14 - the Elements: the First Four Main Groups
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The Global Potential Energy Surfaces of the Lowest Two 1A' States of The
Iowa State University Capstones, Theses and Retrospective Theses and Dissertations Dissertations 1992 The global potential energy surfaces of the lowest two 1A' states of the ozone molecule: theoretical determination and analysis Gregory John Atchity Iowa State University Follow this and additional works at: https://lib.dr.iastate.edu/rtd Part of the Atomic, Molecular and Optical Physics Commons, and the Physical Chemistry Commons Recommended Citation Atchity, Gregory John, "The global potential energy surfaces of the lowest two 1A' states of the ozone molecule: theoretical determination and analysis " (1992). Retrospective Theses and Dissertations. 10093. https://lib.dr.iastate.edu/rtd/10093 This Dissertation is brought to you for free and open access by the Iowa State University Capstones, Theses and Dissertations at Iowa State University Digital Repository. It has been accepted for inclusion in Retrospective Theses and Dissertations by an authorized administrator of Iowa State University Digital Repository. For more information, please contact [email protected]. INFORMATION TO USERS This manuscript has been reproduced from the microfilm master. UMI films the text directly firom the original or copy submitted. Thus, some thesis and dissertation copies are in typewriter face, while others may be from any type of computer printer. The quality of this reproduction is dependent upon the quality of the copy submitted. Broken or indistinct print, colored or poor quality illustrations and photographs, print bleedthrough, substandard margins, and improper alignment can adversely affect reproduction. In the unlikely event that the author did not send UMI a complete manuscript and there are missing pages, these will be noted. Also, if unauthorized copyright material had to be removed, a note will indicate the deletion. -
Midterm 2 Examination Key
GLY4200C Name 90 points October 26, 2011 16 took exam - Numbers to the left of the question number in red are the number of incorrect responses. Instructor comments are in blue. Florida Atlantic University MINERALOGY -- MIDTERM 2 EXAMINATION KEY True-False - Print the letter T or F in the blank to indicate if each of the following statements is true or false. Illegible answers are wrong. (1 point each) 0 T 1. All mathematical groups, including crystallographic point and space groups, must contain an identity operation. 2 F 2. All pyramidal forms are closed. 11 F 3. As nuclei grow, their surface area/volume ratio increases. 1 F 4. Growth twins are always penetration twins. 2 T 5. Low-spin Fe3+ is smaller than high-spin Fe3+. 0 T 6.As pressure increases, minerals transform to denser structures, with atoms packed more closely together 1 T 7. Although silicon normally has CN = IV, in the lower mantle the pressures are so great that the CN of silicon is VI. 2 F 8. If two ions have the same charge, the larger ion will enter a crystal structure preferentially. 2 T 9. Crystal classes are defined by the thirty-two possible point groups. 11 F 10. Possible symmetry operations include rotation axes, mirror planes, and an inversion center. What is wrong with this statement? 0 T 11. Faces composed of all anions or all cations are very high energy. They attract ions of opposite sign, grow rapidly, and may grow themselves out of existence. 1 T 12. The calculation of the zone axis is done using the same method as a vector cross- product. -
1.1 Effective Nuclear Charge 1.2 Effective Nuclear Charge 1.3
Periodic Trends Periodic Trends 1.1 Effective Nuclear Charge 1.2 Effective Nuclear Charge The interaction between the nuclear charge and the Zeff = nuclear charge actually experienced by an valence electrons (how many? how far away?) is electron critical Simplest approximation The nuclear charge experienced by the valence Zeff = Z - # core electrons electrons (Zeff ) impacts how tightly the valence electrons are held Assumption How tightly the valence electrons are held influences atomic size, ionization energy, electron affinity, and Examples reactivity Periodic Trends Periodic Trends 1.3 Effective Nuclear Charge 1.4 Slater’s Rules Slater’s rules acknowledge the imperfect shielding Slater’s rules assume imperfect shielding caused by orbital penetration Zeff = Z – where is calculated using Slater’s rules 1. GthbitlidGroup the orbitals in order: (1s) (2s,2p) (3s,3p) (3d) (4s,4p) (4d) (4f) (5s,5p)… 2. To determine , sum up the following contributions for the electron of interest: a. 0 (zero) for all electrons in groups outside (to the right of) the one being considered b. 0.35 for each of the other electrons in the same ggp(proup (except for 1s group where 0.30 is used) c. If the electron is in a (ns,np) group, 0.85 for each electron in the next innermost (to the left) group d. If the electron is in a (nd) or (nf) group, 1.00 for each electron in the next innermost (to the left) group e. 1.00 for each electron in the still lower (farther in) groups 1 Periodic Trends Periodic Trends 1.5 Using Slater’s Rules 1.6 Using Slater’s Rules What do the 1.0, 0.85 and 0.35 factors mean? Fluorine’s Zeff calculated using the simple approximation = 7 and using Slater’s rules = 5.20. -
Economic Diversification Plan for East Kern County
FEBRUARY 2017 ECONOMIC DIVERSIFICATION PLAN EAST KERN COUNTY, CA KERN COUNTY ACKNOWLEDGEMENTS TIP Strategies would like to thank the many individuals who participated in the creation of this Economic Diversification Plan. We are especially grateful to the members of the East Kern Economic Alliance who contributed their time and input throughout this planning process. Their expertise helped us gain a deep understanding of the region’s range of assets and opportunities. We are also thankful for the US Department of Defense Office of Economic Adjustment for their visionary investments and support which helped make this project a reality. We also want to thank the leadership and staff of Kern County and the Kern EDC for their essential support, guidance, and feedback during the development of this plan. EAST KERN ECONOMIC ALLIANCE KEY STAKEHOLDERS Richard Chapman, President & CEO Jennifer Wood, Mayor Gary Parsons, Economic Kern Economic Development California City Development Manager Corporation City of Ridgecrest Karina Drees, CEO and General Bill Deaver, Michelle Vance, Economic Manager Edwards Community Alliance Development Coordinator Mojave Air & Spaceport City of Tehachapi Kimberly Maevers, President Kelly Bearden, Director Ryan Rush, Field Representative Greater Antelope Valley Economic CSU-Bakersfield SBDC Kern County Board of Supervisors, Alliance 2nd District KERN COUNTY PROJECT TEAM Supervisor Zach Scrivner, Chairman of the Kern County Board of Supervisors & 2nd District Supervisor Teresa Hitchcock, Assistant County Administrative -
Molecular Orbital Theory to Predict Bond Order • to Apply Molecular Orbital Theory to the Diatomic Homonuclear Molecule from the Elements in the Second Period
Skills to Develop • To use molecular orbital theory to predict bond order • To apply Molecular Orbital Theory to the diatomic homonuclear molecule from the elements in the second period. None of the approaches we have described so far can adequately explain why some compounds are colored and others are not, why some substances with unpaired electrons are stable, and why others are effective semiconductors. These approaches also cannot describe the nature of resonance. Such limitations led to the development of a new approach to bonding in which electrons are not viewed as being localized between the nuclei of bonded atoms but are instead delocalized throughout the entire molecule. Just as with the valence bond theory, the approach we are about to discuss is based on a quantum mechanical model. Previously, we described the electrons in isolated atoms as having certain spatial distributions, called orbitals, each with a particular orbital energy. Just as the positions and energies of electrons in atoms can be described in terms of atomic orbitals (AOs), the positions and energies of electrons in molecules can be described in terms of molecular orbitals (MOs) A particular spatial distribution of electrons in a molecule that is associated with a particular orbital energy.—a spatial distribution of electrons in a molecule that is associated with a particular orbital energy. As the name suggests, molecular orbitals are not localized on a single atom but extend over the entire molecule. Consequently, the molecular orbital approach, called molecular orbital theory is a delocalized approach to bonding. Although the molecular orbital theory is computationally demanding, the principles on which it is based are similar to those we used to determine electron configurations for atoms. -
CHEM 1A03 UNIT 3: Periodic Trends Introduction
CHEM 1A03 UNIT 3: Periodic Trends Introduction Hey! Thanks for opening up this Chemistry Periodic Trends Review! The education team at WebStraw McMaster has put together a comprehensive breakdown for you that covers all the key concepts for Chemistry Periodic Trends Members of our team have taken the course in previous years, and we understand better than anyone else what specific ideas and concepts tend to trip students up throughout the semester. We are essentially offering you the key takeaways from the course, after having completed the course ourselves. Before you read further, also keep in mind that these review packages are not meant to be a tool for you to learn the course from scratch. The content presented below was designed with the assumption that you already have a preliminary understanding of Periodic Trends. Our goal is to help give you a more in-depth understanding of key outcomes, as well as to help you see how concepts relate/connect to one another within the scope of the course as a whole. We do our best to cover every topic within the unit; however, some testable outcomes may not be discussed. With that said, best of luck in your studying! Remember to make good use of your time, but to also take breaks as well. Yousef Abumustafa & Julia Ma The WebStraw McMaster Chemistry team WebStraw McMaster Periodic properties of elements The periodic table is divided into called columns called groups that group elements with similar chemical/physical properties together and rows called periods that group elements with the same -
Working with Hazardous Chemicals
A Publication of Reliable Methods for the Preparation of Organic Compounds Working with Hazardous Chemicals The procedures in Organic Syntheses are intended for use only by persons with proper training in experimental organic chemistry. All hazardous materials should be handled using the standard procedures for work with chemicals described in references such as "Prudent Practices in the Laboratory" (The National Academies Press, Washington, D.C., 2011; the full text can be accessed free of charge at http://www.nap.edu/catalog.php?record_id=12654). All chemical waste should be disposed of in accordance with local regulations. For general guidelines for the management of chemical waste, see Chapter 8 of Prudent Practices. In some articles in Organic Syntheses, chemical-specific hazards are highlighted in red “Caution Notes” within a procedure. It is important to recognize that the absence of a caution note does not imply that no significant hazards are associated with the chemicals involved in that procedure. Prior to performing a reaction, a thorough risk assessment should be carried out that includes a review of the potential hazards associated with each chemical and experimental operation on the scale that is planned for the procedure. Guidelines for carrying out a risk assessment and for analyzing the hazards associated with chemicals can be found in Chapter 4 of Prudent Practices. The procedures described in Organic Syntheses are provided as published and are conducted at one's own risk. Organic Syntheses, Inc., its Editors, and its Board of Directors do not warrant or guarantee the safety of individuals using these procedures and hereby disclaim any liability for any injuries or damages claimed to have resulted from or related in any way to the procedures herein. -
Important Factoids in Understanding Effective Nuclear Charge
CHEM 1B Important Factoids in Understanding Effective Nuclear Charge To understand the concept of effective nuclear charge, we focus on one electron (usually a valence or outer electron) and consider the forces the other charged particles exert on this electron. In an atom with more than one electron, each electron will ‘feel’ both attractive forces from the positive nucleus and repulsive forces from the other electrons. Qualitatively, Zeff is the NET (or effective) ATTRACTIVE charge that the electron ‘feels’, taking into account both the attractive and repulsive forces. The attractive part of Zeff is just Z, the positive charge on the nucleus ‘pulling’ on the electron (i.e. the atomic number) The repulsive part, repulsion from the other electrons, is referred to as ‘shielding’. It gets this designation because an electron is ‘shielded’ from the pull of the positive nucleus by the repulsion of the other electrons. To provide shielding an electron must have its probability density closer to the nucleus than the outer electron (and thus partially neutralize the + nuclear charge). Thus Zeffective=+Z ‐(shielding of other electrons) [note the + sign for the attractive part and –sign for the repulsive part] MORE SHIELDING ï LOWER Zeff LESS SHIELDING ï HIGHER Zeff In terms of Zeff and the principal quantum number n of the outer electron, the ionization energy and size of an atom can be approximated as: 22 2 18ZZeff 18 eff 11 n EnZeff, 2.18 10 J22 and IE 2.18 10 J and ravg 5.28 10 m nn Zeff An approximate Zeff can be obtained empirically from experimental ionization energies: 12 nIE2 experimental Zeff 18 2.18 10 J The lecture will discuss: For 1‐electron atoms or ions [H, He+, Li2+, Be3+, etc.] there is no shielding and Zeff∫Z [Z=+1, +2, +3, +4, etc.] For He 1s2 the second electron (in the same 1s shell) provides 0.66 shielding [reduces the pull of the nucleus from Z= +2 to Zeffº1.34] For Li 1s22s each of the two 1s electrons provides 0.84 shielding for the outer 2s electron [the two reduce the pull of the nucleus from Z=+3 to Zeffº3‐2ä0.87=1.26. -
AP Chemistry: 2017-18 Semester Review: Chapters 6 Thru 9, 11.2-11.3
AP Chemistry: 2017-18 Semester Review: MULTIPLE CHOICE Section Chapters 6 thru 9, 11.2-11.3 Chp. 6 1) Which one of the following is correct? A) ν ÷ λ = c B) ν = cλ C) λ = c ν D) νλ = c E) ν + λ = c Page Ref: Sec. 6.1 2) In the Bohr model of the atom, _____. A) electrons travel in circular paths called orbitals B) electron paths are controlled by probability C) electrons can have any energy D) electron energies are quantized E) both A and C Page Ref: Sec. 6.3 3) Which one of the following is an incorrect orbital notation? A) 4dxy B) 3py C) 4s D) 2s E) 3f Page Ref: Sec. 6.5 4) Which electron configuration represents a violation of the Pauli exclusion principle? A) B) C) D) E) Page Ref: Sec. 6.8 1 5) The ground state electron configuration of Ga is __________. A) B) C) D) E) [Ar] Page Ref: Sec. 6.8 6) Which electron configuration represents a violation of Hund's rule for an atom in its ground state? A) B) C) D) E) Page Ref: Sec. 6.8 7) Which two elements have the same ground-state electron configuration? A) Pd and Pt B) Fe and Cu C) Cu and Ag D) Cl and Ar E) No two elements have the same ground-state electron configuration. Page Ref: Sec. 6.8 Chp. 7 1) In which set of elements would all members be expected to have very similar chemical properties? A) O, S, Se B) S, Se, Si C) N, O, F D) Ne, Na, Mg E) Na, Mg, K Page Ref: Sec. -
Particularly Hazardous Substances
Particularly Hazardous Substances In its Laboratory Standard, OSHA requires the establishment of additional protections for persons working with "Particularly Hazardous Substances" (PHS). OSHA defines these materials as "select" carcinogens, reproductive toxins and acutely toxic materials. Should you wish to add: explosive, violently reactive, pyrophoric and water-reactve materials to this category, the information is included. Carbon nanotubes have also been added due to their suspected carcinogenic properties. This table is designed to assist the laboratory in the identification of PHS, although it is not definitively conclusive or entirely comprehensive. *Notes on the proper use of this table appear on page 12. 1 6 5 2 3 4 Substance CAS National Toxicity National Program Carcinogen Toxin Acute Regulated OSHA Carcinogen Group IARC Carcinogen Toxin Reproductive Violently Reactive/ Explosive/Peroxide Forming/Pyrophoric A-a-C(2-Amino-9H-pyrido[2,3,b]indole) 2648-68-5 2B Acetal 105-57-7 yes Acetaldehyde 75-07-0 NTP AT 2B Acrolein (2-Propenal) 107-02-8 AT Acetamide 126850-14-4 2B 2-Acetylaminofluorene 53-96-3 NTP ORC Acrylamide 79-06-6 NTP 2B Acrylyl Chloride 814-68-6 AT Acrylonitrile 107-13-1 NTP ORC 2B Adriamycin 23214-92-8 NTP 2A Aflatoxins 1402-68-2 NTP 1 Allylamine 107-11-9 AT Alkylaluminums varies AT Allyl Chloride 107-05-1 AT ortho-Aminoazotoluene 97-56-3 NTP 2B para-aminoazobenzene 60-09-3 2B 4-Aminobiphenyl 92-67-1 NTP ORC 1 1-Amino-2-Methylanthraquinone 82-28-0 NTP (2-Amino-6-methyldipyrido[1,2-a:3’,2’-d]imidazole) 67730-11-4 2B -
Lanthanides.Pdf
Lanthanides [A] LANTHANIDES : 4f block elements Definition: The f- block (inner transition) elements containing partially filled 4f-subshells are known as Lanthanides or Lanthanones because of their close similarities with element lanthanum (atomic no: 57). The fourteen elements from atomic no: 58 to 71 constitute lanthanides. Nos. Name Symbol Electronic configuration 0 1 2 1. Lanthanum La57 [Xe] 4f 5d 6s 2 0 2 2. Cerium Ce58 [Xe] 4f 5d 6s 3 0 2 3. Praseodymium Pr59 [Xe] 4f 5d 6s 4 0 2 4. Neodymium Nd60 [Xe] 4f 5d 6s 5 0 2 5. Promethium Pm61 [Xe]4f 5d 6s 6 0 2 6. Samarium Sm62 [Xe]4f 5d 6s 7 0 2 7. Europium Eu63 [Xe] 4f 5d 6s 7 1 2 8. Gadolinium Gd64 [Xe] 4f 5d 6s 9 0 2 9. Terbium Tb65 [Xe] 4f 5d 6s 10 0 2 10. Dysprosium Dy66 [Xe] 4f 5d 6s 11 0 2 11. Holmium Ho67 [Xe] 4f 5d 6s 12 0 2 12. Erbium Er68 [Xe] 4f 5d 6s 13 0 2 13. Thulium Tm69 [Xe] 4f 5d 6s 14 0 2 14. Ytterbium Yb70 [Xe] 4f 5d 6s 14 1 2 15. Lutetium Lu71 [Xe] 4f 5d 6s From the above electronic configuration it can be seen that at La 5d orbital is singly occupied but after La further filling of 5d orbital is discontinued. As the nuclear charge increases by one unit from La to Ce, 4f orbitals were higher in energy upto Lu, fall slightly below the 5d level 4f- orbitals, therefore begin to fill and are completely filled up to Lu, before filling of 5d orbital is resumed. -
THE MAIN-GROUP ELEMENTS Atomic Properties
THE MAIN-GROUP ELEMENTS Atomic Properties Properties of elements is based valence-shell electron configurations. Five atomic properties: 1. atomic radius 2. ionization energy 3. electron affinity 4. electronegativity 5. polarizability Atomic Size Adding more valence levels increases the distance from the electrons to the nucleus, it also decrease the effect the nucleus has on the outer electrons. decreases across a period Effective Nuclear Force increases down a group Valence levels Ionization Energy Ionization energy: the energy required to remove the most loosely held electron from an atom in the gaseous state. Size of Atom Ionization Energy Smaller size Higher ionization energy Electron Affinity The electron affinity is a release of energy to form an anion. Ionization Energy Electron Affinity Atoms with higher effective nuclear charges release more energy. Electronegativity Electronegativity is the tendency of an atom to attract electrons to itself. Ionization Energy Electronegativity Atoms with a greater effective nuclear charge have a stronger pull on bonding electrons. Large differences in electronegativity typically form ionic bonds and small differences from covalent bonds. Polarizability Polarizability is the ease an atoms electron cloud can be distorted. Size of Atom Polarizability Electron-rich, heavier atoms are easily polarized. High polarizing power atom-are small sized, highly charged atoms. Bonding Trends Elements in period 2 strictly follow the octet rule; carbon forms four bonds. Elements in Period 3 and higher periods exceed the octet. They reach higher oxidation states because they can access empty d-orbitals. Also, larger atoms can simply make more bonds to more neighbors . Group 1A: Alkali Metals The chemical properties of alkali metals are striking similar.