Geometry & MOs

Info

ID:	22729
PubChem CID:	598417
Reduced:	OC6H6 (2)
Stoich.:	AB6C6 (2)
Weight, g/mol:	188.08373
ΔH_f, kcal/mol:	-57.11
Dipole, Da:	3.75
IP(EA), eV:	-9.14(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(hydroxymethyl)naphthalen-2-yl]methanol

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C(=CC2=C1)CO)CO

DOS

IR

Vibrations