Geometry & MOs

Info

ID:	235256
PubChem CID:	92304293
Reduced:	FON2C27H27 (1)
Stoich.:	ABC2D27E27 (1)
Weight, g/mol:	414.210742
ΔH_f, kcal/mol:	-23.34
Dipole, Da:	5.72
IP(EA), eV:	-8.26(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@@H](CC(=O)N[C@@H](C)C3=CC=CC=C3)C4=CC=C(C=C4)F

DOS

IR

Vibrations