Title: | 8c_9c_TSS_CH2_ACN_ACN |
Browse item: | https://iochem-bd.bsc.es:443/browse/handle/100/199591 |
Program: | Gaussian 09 AM64L-G09RevD.01 |
Author: | Laconsay, Croix |
Formula: | |
Calculation type: | Single point Structure |
Method(s): | RB3LYP |
Charge / Multiplicity: |
X | Y | Z | Total |
---|---|---|---|
-1.1657 | -1.5689 | 4.2315 | 4.6611 |
XX | YY | ZZ | XY | XZ | YZ |
---|---|---|---|---|---|
-144.4761 | -201.6632 | -195.4613 | 2.3390 | -11.4585 | 0.0025 |