Geometry & MOs

Info

ID:	169147
PubChem CID:	75067893
Reduced:	NO5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	376.142307
ΔH_f, kcal/mol:	-135.85
Dipole, Da:	1.32
IP(EA), eV:	-8.7(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(1,3-benzodioxol-5-yl)-1-hydrazinyl-2-phenylethylidene]-3-hydroxy-4-methylcyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(C)(C)C2=CC3=C(C=C2)OCO3)NOC)C(=O)C=C1O

DOS

IR

Vibrations