Geometry & MOs

Info

ID:	235282
PubChem CID:	92304336
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	412.215078
ΔH_f, kcal/mol:	-99.59
Dipole, Da:	2.48
IP(EA), eV:	-8.19(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(4-methoxyphenyl)-3-(1-methylindol-3-yl)-N-[(1R)-1-phenylethyl]propanamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)C[C@@H](C1=CC(=CC(=C1)OC)OC)C2=CN(C3=CC=CC=C32)CC

DOS

IR

Vibrations