Geometry & MOs

Info

ID:	235287
PubChem CID:	92304348
Reduced:	O2N3H23C24 (1)
Stoich.:	A2B3C23D24 (1)
Weight, g/mol:	388.251464
ΔH_f, kcal/mol:	8.04
Dipole, Da:	3.13
IP(EA), eV:	-8.39(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclohexyl-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1[C@H](CC(=O)NCC2=CN=CC=C2)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations