Geometry & MOs

Info

ID:	194832
PubChem CID:	78596015
Reduced:	ON3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	380.151826
ΔH_f, kcal/mol:	-2.23
Dipole, Da:	5.62
IP(EA), eV:	-8.97(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methylcyclohexylidene)amino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline

Drug info:

PubChemData

Smile

CC(=O)N(CC1=NC=CN1C)C2CCCC3=CC=CC=C23

DOS

IR

Vibrations