Geometry & MOs

Info

ID:	223378
PubChem CID:	85334937
Reduced:	SO2N5C12H13 (1)
Stoich.:	AB2C5D12E13 (1)
Weight, g/mol:	292.109944
ΔH_f, kcal/mol:	26.44
Dipole, Da:	5.46
IP(EA), eV:	-8.4(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-benzylidene-6-hydroxy-2-methylinden-1-yl)acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C=NN=C(N)N

DOS

IR

Vibrations