Geometry & MOs

Info

ID:	309514
PubChem CID:	126546780
Reduced:	FO3C10H11 (2)
Stoich.:	AB3C10D11 (2)
Weight, g/mol:	340.168602
ΔH_f, kcal/mol:	-310.05
Dipole, Da:	5.3
IP(EA), eV:	-9.14(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[1-(2-fluoro-5-hydroxy-4-methoxyphenyl)propan-2-yl]-1,4-dioxaspiro[4.5]decan-8-ol

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1C[C@]2(C(=CC1=O)OCO2)[C@@H](C)CC3=CC(=C(C=C3F)OC)F

DOS

IR

Vibrations