Geometry & MOs

Info

ID:	169394
PubChem CID:	75099149
Reduced:	ON3C25H27 (1)
Stoich.:	AB3C25D27 (1)
Weight, g/mol:	373.196569
ΔH_f, kcal/mol:	48.27
Dipole, Da:	15.23
IP(EA), eV:	-8.14(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-4-[(3,4-difluorophenyl)methylamino]-N-ethylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CNC(=C2C=CC(=O)C(=C2)CNC(CC3=CC=CC=C3)C4=CC=CC=C4)NC1

DOS

IR

Vibrations