Geometry & MOs

Info

ID:	65732
PubChem CID:	46386800
Reduced:	ON2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	420.098918
ΔH_f, kcal/mol:	10.08
Dipole, Da:	5.0
IP(EA), eV:	-8.35(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-chloro-2-pyridin-4-yl-1H-indol-3-yl)carbamoylamino]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)NC2=C(NC3=CC=CC=C32)C4=CC=NC=C4

DOS

IR

Vibrations