Geometry & MOs

Info

ID:	79849
PubChem CID:	49830821
Reduced:	ON4H20C22 (1)
Stoich.:	AB4C20D22 (1)
Weight, g/mol:	302.105528
ΔH_f, kcal/mol:	65.98
Dipole, Da:	6.22
IP(EA), eV:	-8.94(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-hydroxyphenyl)-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)CNC(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CC=C4)C

DOS

IR

Vibrations