Geometry & MOs

Info

ID:	380973
PubChem CID:	134971587
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	395.95264
ΔH_f, kcal/mol:	-124.91
Dipole, Da:	8.68
IP(EA), eV:	-10.04(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-chloropyridin-3-yl)-(3-iodo-1-methylindol-2-yl)methanone

Drug info:

PubChemData

Smile

CC(=CC(=O)C1CC=CC[C@@H]1C(=O)O)C

DOS

IR

Vibrations