✦ LIBER ✦

Comparative computational analysis of some nitramine and difluoramine structures, dissociation energies and heats of formation

✍ Scribed by Peter Politzer; Pat Lane; M. Edward Grice; Monica C. Concha; Paul C. Redfern

Book ID: 113258373
Publisher: Elsevier Science
Year: 1995
Tongue: English
Weight: 457 KB
Volume: 338
Category: Article
ISSN: 0166-1280
DOI: 10.1016/0166-1280(94)04064-y

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Heats of Formation of Mercury Dimethyl,

Heats of Formation of Mercury Dimethyl, Diethyl and Diphenyl and some Associated Bond Dissociation Energies

✍ CARSON, A. S.; CARSON, E. M.; WILMSHURST, B. 📂 Article 📅 1952 🏛 Nature Publishing Group 🌐 English ⚖ 213 KB

A High-Level Computational Study on the

A High-Level Computational Study on the Thermochemistry of Vinyl and Formyl Halides: Heats of Formation, Dissociation Energies, and Stabilization Energies

✍ Glukhovtsev, Mikhail N.; Bach, Robert D. 📂 Article 📅 1997 🏛 American Chemical Society 🌐 English ⚖ 152 KB

An ab initio study of the structure, dis

An ab initio study of the structure, dissociation energy, and heat of formation of Na2S

✍ Yongfang Zhao; Tingkun Gu; Soufu Pan; Jing Sun 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 148 KB 👁 1 views

The equilibrium geometries and fundamental frequencies of Na S are calculated at HF, 2 Ž . Ž . Ž . MP2 FC, FU , and MP3 with the 6-31G d basis set and at HF and MP2 FC, FU with the Ž . Ž . Ž . 6-31G d basis set, respectively. The total energy at MP2 FU r6-31G d -optimized Ž . Ž . Ž . geometry is com

Homopolar and Heteropolar Bond Dissociat

Homopolar and Heteropolar Bond Dissociation Energies and Heats of Formation of Radicals and Ions in the Gas Phase II. The relationship between structure and bond dissociation in organic molecules

✍ Kurt W. Egger; Alan T. Cocks 📂 Article 📅 1973 🏛 John Wiley and Sons 🌐 German ⚖ 944 KB

## Abstract The preceeding paper presents a critical tabular compilation of 2‐center homo‐ and heteropolar bond dissociation energies. This paper deals with some empirically derived general aspects of these data, particularly regarding relationships between structure and reactivity, __i.e__. substi

Stabilities, Excitation Energies, and Di

Stabilities, Excitation Energies, and Dissociation Reactions of CF 2 Cl 2 and CF 2 Br 2 : Quantum Chemical Computations of Heats of Formation of Fluorinated Methanes, Methyls, and Carbenes

✍ Cameron, Melanie R.; Bacskay, George B. 📂 Article 📅 2000 🏛 American Chemical Society 🌐 English ⚖ 83 KB

Structures, Bond Energies, Heats of Form

Structures, Bond Energies, Heats of Formation, and Quantitative Bonding Analysis of Main-Group Metallocenes [E(Cp)2] (E=Be–Ba, Zn, Si–Pb) and [E(Cp)] (E=Li–Cs, B–Tl)

✍ Víctor M. Rayón; Gernot Frenking 📂 Article 📅 2002 🏛 John Wiley and Sons 🌐 English ⚖ 293 KB