Geometry & MOs

Info

ID:	235617
PubChem CID:	92710179
Reduced:	ON2C17H20 (1)
Stoich.:	AB2C17D20 (1)
Weight, g/mol:	338.118591
ΔH_f, kcal/mol:	1.22
Dipole, Da:	3.94
IP(EA), eV:	-8.76(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(3-chloro-2-methylphenyl)-3-phenyl-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C[C@H](C2=CC=CC=C2)N3C=CC=C3

DOS

IR

Vibrations