Geometry & MOs

Info

ID:	65663
PubChem CID:	46386727
Reduced:	O3N4C18H18 (1)
Stoich.:	A3B4C18D18 (1)
Weight, g/mol:	420.098918
ΔH_f, kcal/mol:	-58.65
Dipole, Da:	2.39
IP(EA), eV:	-8.42(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)CNC(=O)NC1=C(NC2=CC=CC=C21)C3=CN=CC=C3

DOS

IR

Vibrations