Title: | /Rh/Va MM3-18-cis-distal-TS-LESS |
Browse item: | https://iochem-bd.iciq.es:443/browse/handle/100/27392 |
Program: | Gaussian 09 EM64L-G09RevD.01 |
Author: | Armengol i Relats, Helena |
Formula: | |
Calculation type: | Single point Structure |
Method(s): | RB3LYP |
Charge / Multiplicity: |
X | Y | Z | Total |
---|---|---|---|
9.0773 | -7.2287 | -6.2644 | 13.1869 |
XX | YY | ZZ | XY | XZ | YZ |
---|---|---|---|---|---|
-260.6612 | -273.8292 | -262.7883 | -7.8765 | -11.4598 | 10.7143 |