Geometry & MOs

Info

ID:	11443
PubChem CID:	115631
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	196.109944
ΔH_f, kcal/mol:	-127.05
Dipole, Da:	2.19
IP(EA), eV:	-8.87(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-(2-methylphenoxy)propane-1,2-diol

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OCC(C)(CO)O

DOS

IR

Vibrations