Title: | i1 |
Browse item: | https://iochem-bd.bsc.es:443/browse/handle/100/192936 |
Program: | Gaussian 09 ES64L-G09RevD.01 |
Author: | Galvao, Tiago |
Formula: | |
Calculation type: | Single point Structure |
Method(s): | RM062X |
Charge / Multiplicity: |
X | Y | Z | Total |
---|---|---|---|
-7.1836 | -1.9089 | -1.3277 | 7.5505 |
XX | YY | ZZ | XY | XZ | YZ |
---|---|---|---|---|---|
-243.1028 | -245.0818 | -246.3068 | 9.0677 | 2.3964 | -14.9684 |