Geometry & MOs

Info

ID:	48479
PubChem CID:	10586612
Reduced:	O2F3C12H15 (1)
Stoich.:	A2B3C12D15 (1)
Weight, g/mol:	248.17763
ΔH_f, kcal/mol:	-240.2
Dipole, Da:	4.15
IP(EA), eV:	-9.14(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-7-methyl-1-phenylmethoxyoct-6-en-3-ol

Drug info:

PubChemData

Smile

CCCCOC1=CC=CC=C1[C@H](C(F)(F)F)O

DOS

IR

Vibrations