Geometry & MOs

Info

ID:	396112
PubChem CID:	135027418
Reduced:	Si2O7C32H62 (1)
Stoich.:	A2B7C32D62 (1)
Weight, g/mol:	399.05318
ΔH_f, kcal/mol:	-446.01
Dipole, Da:	4.78
IP(EA), eV:	-8.84(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;benzoic acid;copper(1+);2-phenylpyridine

Drug info:

PubChemData

Smile

CC[C@@H]1[C@@](/C=C(/C(=O)CC[C@@]([C@@H](C[C@@H]([C@H](C(=O)O1)C)O[Si](C)(C)C(C)(C)C)O[Si](CC)(CC)CC)(C)OC)\C)(C)O

DOS

IR

Vibrations