Geometry & MOs

Info

ID:	377941
PubChem CID:	134224008
Reduced:	NCl2O3H13C18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	471.019576
ΔH_f, kcal/mol:	-74.7
Dipole, Da:	3.67
IP(EA), eV:	-9.36(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-chloro-3-(4-chlorobenzoyl)-1-(4-chlorophenyl)indole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations