Geometry & MOs

Info

ID:	174854
PubChem CID:	75822679
Reduced:	NSO4C18H26 (1)
Stoich.:	ABC4D18E26 (1)
Weight, g/mol:	351.137853
ΔH_f, kcal/mol:	-105.62
Dipole, Da:	13.92
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.813429
Charge, e:	-1

Chem-info

IUPAC name:

2-acetamido-2-cyclopentyl-N-(2,5-dimethylphenyl)sulfonylethanimidate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)N=C(CCC2CCCO2)[O-]

DOS

IR

Vibrations