Geometry & MOs

Info

ID:	395305
PubChem CID:	135025147
Reduced:	SF3O4H13C14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	368.219889
ΔH_f, kcal/mol:	-269.66
Dipole, Da:	4.62
IP(EA), eV:	-8.86(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-[(2S,3R)-2-(2-methoxyethenyl)-1,4-dioxaspiro[4.5]decan-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=C(C=CC2=C(C1)C=CC(=C2)OC)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations