Geometry & MOs

Info

ID:	235445
PubChem CID:	92709656
Reduced:	ClON2C21H21 (1)
Stoich.:	ABC2D21E21 (1)
Weight, g/mol:	296.188863
ΔH_f, kcal/mol:	9.89
Dipole, Da:	3.56
IP(EA), eV:	-8.9(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclopentyl-3-(2-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@H](CC(=O)NCC2=CC=C(C=C2)Cl)N3C=CC=C3

DOS

IR

Vibrations