Geometry & MOs

Info

ID:	377996
PubChem CID:	134224063
Reduced:	NO3Cl4H11C22 (1)
Stoich.:	AB3C4D11E22 (1)
Weight, g/mol:	437.058549
ΔH_f, kcal/mol:	-56.63
Dipole, Da:	4.7
IP(EA), eV:	-9.48(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(4-chlorobenzoyl)-1-(3-chlorophenyl)indole-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N2C3=C(C=CC(=C3)Cl)C(=C2C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl)Cl

DOS

IR

Vibrations