Geometry & MOs

Info

ID:	377948
PubChem CID:	134224015
Reduced:	NO6C24H29 (1)
Stoich.:	AB6C24D29 (1)
Weight, g/mol:	467.069114
ΔH_f, kcal/mol:	-203.1
Dipole, Da:	15.93
IP(EA), eV:	-8.97(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1CC2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)OC)OCC4(CC4)COC

DOS

IR

Vibrations