Geometry & MOs

Info

ID:	235243
PubChem CID:	92304270
Reduced:	ON2C25H30 (1)
Stoich.:	AB2C25D30 (1)
Weight, g/mol:	420.140469
ΔH_f, kcal/mol:	-18.01
Dipole, Da:	3.92
IP(EA), eV:	-8.31(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-3-(1-methylindol-3-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@H](CC(=O)NC2CCCCC2)C3=CN(C4=CC=CC=C43)C

DOS

IR

Vibrations