Geometry & MOs

Info

ID:	387867
PubChem CID:	134987198
Reduced:	ON2H12C14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	236.08373
ΔH_f, kcal/mol:	35.07
Dipole, Da:	1.76
IP(EA), eV:	-8.78(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-hydroxyphenyl)-4H-naphthalen-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C3C=CC(=CC3=N2)OC

DOS

IR

Vibrations