Geometry & MOs

Info

ID:	122761
PubChem CID:	50820438
Reduced:	SN2O5C22H28 (1)
Stoich.:	AB2C5D22E28 (1)
Weight, g/mol:	444.171893
ΔH_f, kcal/mol:	-151.62
Dipole, Da:	7.1
IP(EA), eV:	-8.9(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)OC)OC

DOS

IR

Vibrations