Geometry & MOs

Info

ID:	286522
PubChem CID:	104170886
Reduced:	O3C13H20 (1)
Stoich.:	A3B13C20 (1)
Weight, g/mol:	238.156895
ΔH_f, kcal/mol:	-128.6
Dipole, Da:	3.77
IP(EA), eV:	-9.62(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxypropyl)-2-(4-methylphenyl)propane-1,3-diol

Drug info:

PubChemData

Smile

CC(CC(CO)(CO)C1=CC=CC=C1)OC

DOS

IR

Vibrations