Geometry & MOs

Info

ID:	425411
PubChem CID:	135126214
Reduced:	SO3N4C16H24 (1)
Stoich.:	AB3C4D16E24 (1)
Weight, g/mol:	359.130363
ΔH_f, kcal/mol:	-100.92
Dipole, Da:	7.87
IP(EA), eV:	-8.19(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)N

DOS

IR

Vibrations