Geometry & MOs

Info

ID:	158137
PubChem CID:	56463044
Reduced:	ClSN2O3C18H21 (1)
Stoich.:	ABC2D3E18F21 (1)
Weight, g/mol:	390.055339
ΔH_f, kcal/mol:	-110.16
Dipole, Da:	6.49
IP(EA), eV:	-8.32(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-4-[(1-phenylpyrazol-4-yl)sulfonylamino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)Cl

DOS

IR

Vibrations