Geometry & MOs

Info

ID:	377972
PubChem CID:	134224039
Reduced:	NO7C25H31 (1)
Stoich.:	AB7C25D31 (1)
Weight, g/mol:	435.128214
ΔH_f, kcal/mol:	-248.48
Dipole, Da:	17.01
IP(EA), eV:	-9.0(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-fluoro-1-(4-fluorophenyl)-3-(4-methoxybenzoyl)indole-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1CC2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)OC)OCC4(COC4)COC

DOS

IR

Vibrations