Geometry & MOs

Info

ID:	235612
PubChem CID:	92710165
Reduced:	N2O3C21H22 (1)
Stoich.:	A2B3C21D22 (1)
Weight, g/mol:	318.173213
ΔH_f, kcal/mol:	-54.67
Dipole, Da:	1.98
IP(EA), eV:	-8.81(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(2-ethylphenyl)-3-phenyl-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations