Geometry & MOs

Info

ID:	449013
PubChem CID:	135295199
Reduced:	N2C16H17 (2)
Stoich.:	A2B16C17 (2)
Weight, g/mol:	482.150954
ΔH_f, kcal/mol:	98.02
Dipole, Da:	5.05
IP(EA), eV:	-8.1(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(5-chloro-1-methyl-6-oxopyridin-3-yl)-1-[(1S)-1-pyridin-2-ylethyl]indol-3-yl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC1)C)C2=CC3=C(C(=CN3C(C4CCCCC4)C5=CC=CC=N5)C6=CC=C(C=C6)C)N=C2

DOS

IR

Vibrations