TSS_2_3

GENERAL INFO

Title:	TSS_2_3
Browse item:	https://iochem-bd.bsc.es:443/browse/handle/100/200865
Program:	Gaussian 09 AM64L-G09RevD.01
Author:	Laconsay, Croix
Formula:
Calculation type:	Single point Structure
Method(s):	RM062X

ATOM INFO

Atomic coordinates [Å]

MOLECULAR INFO

Charge / Multiplicity:

JOB |

Energies

Mulliken charges

Dipole moment (Debye)

Dipole moment

X	Y	Z	Total
-10.1338	-16.6583	3.2937	19.7747

Quadrupole moment

XX	YY	ZZ	XY	XZ	YZ
-116.1496	-132.1757	-102.0749	-14.6712	11.0785	5.6628

JOB |

Energies

Mulliken charges

Dipole moment (Debye)

Dipole moment

X	Y	Z	Total
-10.1338	-16.6583	3.2937	19.7747

Quadrupole moment

XX	YY	ZZ	XY	XZ	YZ
-116.1496	-132.1757	-102.0749	-14.6712	11.0785	5.6628

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