Geometry & MOs

Info

ID:	406204
PubChem CID:	135076866
Reduced:	SF3O4C12H13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	240.20893
ΔH_f, kcal/mol:	-298.32
Dipole, Da:	4.13
IP(EA), eV:	-10.45(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2S,3S)-3-[(E)-hex-1-enyl]oxiran-2-yl]heptan-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations