Geometry & MOs

Info

ID:	66503
PubChem CID:	46504697
Reduced:	BrClNOH9C15 (1)
Stoich.:	ABCDE9F15 (1)
Weight, g/mol:	343.02079
ΔH_f, kcal/mol:	20.76
Dipole, Da:	1.24
IP(EA), eV:	-9.02(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-5-bromo-3-[(2-ethoxyphenyl)methylidene]-1H-indol-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C=C\2/C3=C(C=CC(=C3)Br)NC2=O)Cl

DOS

IR

Vibrations