Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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A | B | C |
---|---|---|
0.03737 | 0.03737 |
Description | Value | Connectivity | Reference | Comment | |||
---|---|---|---|---|---|---|---|
Atom 1 | Atom 2 | Atom 3 | Atom 4 | ||||
rII | 2.665 | 1 | 2 | Gurvich | re |
Bond Type | Count |
---|---|
I-I | 1 |
Atom | x (Å) | y (Å) | z (Å) |
---|---|---|---|
I1 | 0.0000 | 0.0000 | 0.0000 |
I2 | 0.0000 | 0.0000 | 2.6655 |
I1 | I2 | |
---|---|---|
I1 | 2.6655 | |
I2 | 2.6655 |
squib | reference | DOI |
---|---|---|
Gurvich | Gurvich, L.V.; Veyts, I. V.; Alcock, C. B., Thermodynamic Properties of Individual Substances, Fouth Edition, Hemisphere Pub. Co., New York, 1989 | |
webbook | NIST Chemistry Webbook (http://webbook.nist.gov/chemistry) | 10.18434/T4D303 |
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