Geometry & MOs

Info

ID:	235255
PubChem CID:	92304292
Reduced:	N2O3C24H30 (1)
Stoich.:	A2B3C24D30 (1)
Weight, g/mol:	414.210742
ΔH_f, kcal/mol:	-83.12
Dipole, Da:	4.0
IP(EA), eV:	-8.21(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(1-ethylindol-3-yl)-3-(4-fluorophenyl)-N-[(1S)-1-phenylethyl]propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations