Geometry & MOs

Info

ID:	26189
PubChem CID:	640648
Reduced:	OH7C8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	160.088815
ΔH_f, kcal/mol:	-27.77
Dipole, Da:	1.56
IP(EA), eV:	-8.29(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-methyl-3,4-dihydro-1H-naphthalen-2-one

Drug info:

PubChemData

Smile

COC1=CC(=C2C(=C1)C=CC3=CC=CC=C32)OC

DOS

IR

Vibrations