Geometry & MOs

Info

ID:	131492
PubChem CID:	51212897
Reduced:	FSO2N3C17H18 (1)
Stoich.:	ABC2D3E17F18 (1)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	-78.84
Dipole, Da:	5.17
IP(EA), eV:	-8.93(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-oxopyrrolidin-1-yl)phenyl]-1-phenylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)F)C(=O)CC2=CSC(=N2)N3CCCC3=O

DOS

IR

Vibrations