Geometry & MOs

Info

ID:	264350
PubChem CID:	103456562
Reduced:	FO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-174.44
Dipole, Da:	2.91
IP(EA), eV:	-9.05(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-(6-methylpyridin-3-yl)butane-1,2-diol

Drug info:

PubChemData

Smile

CC(C)C(C(C1=CC(=C(C=C1)OC)F)O)O

DOS

IR

Vibrations