Geometry & MOs

Info

ID:	235606
PubChem CID:	92710149
Reduced:	N2O3C21H22 (1)
Stoich.:	A2B3C21D22 (1)
Weight, g/mol:	350.163043
ΔH_f, kcal/mol:	-43.27
Dipole, Da:	3.08
IP(EA), eV:	-8.01(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(2,4-dimethoxyphenyl)-3-phenyl-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)C[C@H](C2=CC=CC=C2)N3C=CC=C3)OC

DOS

IR

Vibrations