Geometry & MOs

Info

ID:	156615
PubChem CID:	56371358
Reduced:	N3O4C27H37 (1)
Stoich.:	A3B4C27D37 (1)
Weight, g/mol:	484.214427
ΔH_f, kcal/mol:	-155.14
Dipole, Da:	7.13
IP(EA), eV:	-7.95(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-oxo-4-(3-pyrrolidin-1-ylanilino)butan-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(=O)NC(C)CC(=O)NC2=CC(=CC=C2)N3CCCC3)OCCC

DOS

IR

Vibrations