Geometry & MOs

Info

ID:	234861
PubChem CID:	92303617
Reduced:	SN2O3H22C24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	412.139862
ΔH_f, kcal/mol:	-53.06
Dipole, Da:	4.75
IP(EA), eV:	-8.65(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(furan-2-ylmethyl)-3-(1H-indol-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2[C@H](SCC2=O)C3=CC(=CC=C3)NC(=O)C4=CC(=CC=C4)OC

DOS

IR

Vibrations