Geometry & MOs

Info

ID:	52485
PubChem CID:	12015363
Reduced:	O2F3H5C7 (1)
Stoich.:	A2B3C5D7 (1)
Weight, g/mol:	138.06808
ΔH_f, kcal/mol:	-158.5
Dipole, Da:	8.6
IP(EA), eV:	-9.85(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-7-methoxyhept-6-en-4-yn-3-one

Drug info:

PubChemData

Smile

CO/C=C\C#CC(=O)C(F)(F)F

DOS

IR

Vibrations