Geometry & MOs

Info

ID:	196063
PubChem CID:	78775564
Reduced:	ON2C16H18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	417.151098
ΔH_f, kcal/mol:	-11.26
Dipole, Da:	4.12
IP(EA), eV:	-9.29(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-N-(1-pyridin-4-ylethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(=O)NC(C)C2=CC=NC=C2

DOS

IR

Vibrations