Geometry & MOs

Info

ID:	124384
PubChem CID:	50881113
Reduced:	ClON3C11H16 (1)
Stoich.:	ABC3D11E16 (1)
Weight, g/mol:	267.11384
ΔH_f, kcal/mol:	-41.46
Dipole, Da:	1.49
IP(EA), eV:	-8.07(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2-chloro-5-pyrrolidin-1-ylphenyl)propanamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=C(C=C(C(=C1)N(C)C)N)Cl

DOS

IR

Vibrations