Geometry & MOs

Info

ID:	235189
PubChem CID:	92304197
Reduced:	ClON2C25H31 (1)
Stoich.:	ABC2D25E31 (1)
Weight, g/mol:	410.212491
ΔH_f, kcal/mol:	-33.38
Dipole, Da:	5.68
IP(EA), eV:	-8.32(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)-N-hexylpropanamide

Drug info:

PubChemData

Smile

CCCCCCNC(=O)C[C@@H](C1=CC(=CC=C1)Cl)C2=CN(C3=CC=CC=C32)CC

DOS

IR

Vibrations