Geometry & MOs

Info

ID:	143509
PubChem CID:	53218735
Reduced:	NSO3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	214.09938
ΔH_f, kcal/mol:	-73.79
Dipole, Da:	6.96
IP(EA), eV:	-9.25(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(hydroxymethyl)phenyl]-2-methylphenol

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)O

DOS

IR

Vibrations