Geometry & MOs

Info

ID:	5213
PubChem CID:	12769
Reduced:	OC9H12 (1)
Stoich.:	AB9C12 (1)
Weight, g/mol:	136.088815
ΔH_f, kcal/mol:	-48.66
Dipole, Da:	1.95
IP(EA), eV:	-8.74(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,5-trimethylphenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)O)C)C

DOS

IR

Vibrations