Geometry & MOs

Info

ID:	367405
PubChem CID:	127324485
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	393.183461
ΔH_f, kcal/mol:	27.45
Dipole, Da:	6.41
IP(EA), eV:	-9.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-4-(4-sulfamoylphenyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

DOS

IR

Vibrations