Geometry & MOs

Info

ID:	47749
PubChem CID:	10535057
Reduced:	FOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	166.135765
ΔH_f, kcal/mol:	-68.19
Dipole, Da:	2.27
IP(EA), eV:	-9.61(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-2-oct-3-ynyloxirane

Drug info:

PubChemData

Smile

C/C(=C\CO)/C1=CC=C(C=C1)F

DOS

IR

Vibrations