Geometry & MOs

Info

ID:	410284
PubChem CID:	135083075
Reduced:	OC4H6 (3)
Stoich.:	AB4C6 (3)
Weight, g/mol:	214.09938
ΔH_f, kcal/mol:	-106.93
Dipole, Da:	4.54
IP(EA), eV:	-9.91(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-5-propan-2-ylnaphthalene-1,2-dione

Drug info:

PubChemData

Smile

CCOC1(CC2=C1CCCC2=O)OCC

DOS

IR

Vibrations