Geometry & MOs

Info

ID:	10818
PubChem CID:	108252
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	196.109944
ΔH_f, kcal/mol:	-123.91
Dipole, Da:	2.67
IP(EA), eV:	-8.83(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethylphenoxy)propane-1,2-diol

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC(CO)O

DOS

IR

Vibrations