Geometry & MOs

Info

ID:	156613
PubChem CID:	56371350
Reduced:	SN4O4C23H30 (1)
Stoich.:	AB4C4D23E30 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-127.95
Dipole, Da:	5.61
IP(EA), eV:	-8.13(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

DOS

IR

Vibrations