Geometry & MOs

Info

ID:	377949
PubChem CID:	134224016
Reduced:	NCl2O4H19C25 (1)
Stoich.:	AB2C4D19E25 (1)
Weight, g/mol:	439.037813
ΔH_f, kcal/mol:	-86.09
Dipole, Da:	5.08
IP(EA), eV:	-9.1(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-1-(4-chlorophenyl)-3-(4-methoxybenzoyl)indole-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1C3=CC=C(C=C3)Cl)C=C(C=C2)Cl)C(=O)C4=CC=C(C=C4)OC

DOS

IR

Vibrations