Geometry & MOs

Info

ID:	235068
PubChem CID:	92303980
Reduced:	SN2O2C20H20 (1)
Stoich.:	AB2C2D20E20 (1)
Weight, g/mol:	380.209993
ΔH_f, kcal/mol:	-25.41
Dipole, Da:	5.68
IP(EA), eV:	-8.66(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(3,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2[C@H](SCC2=O)C3=CC(=CC=C3)NC(=O)C4CC4

DOS

IR

Vibrations