Geometry & MOs

Info

ID:	286523
PubChem CID:	104170887
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	258.102272
ΔH_f, kcal/mol:	-138.9
Dipole, Da:	4.11
IP(EA), eV:	-9.34(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(CC(C)OC)(CO)CO

DOS

IR

Vibrations