Geometry & MOs

Info

ID:	234946
PubChem CID:	92303763
Reduced:	SN2O2C24H30 (1)
Stoich.:	AB2C2D24E30 (1)
Weight, g/mol:	388.176248
ΔH_f, kcal/mol:	-84.04
Dipole, Da:	1.71
IP(EA), eV:	-8.9(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-butyl-3-(1H-indol-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CCCCCCC(=O)NC1=CC=CC(=C1)[C@@H]2N(C(=O)CS2)C3=CC(=CC(=C3)C)C

DOS

IR

Vibrations