Geometry & MOs

Info

ID:	394642
PubChem CID:	135023380
Reduced:	OC12H16 (1)
Stoich.:	AB12C16 (1)
Weight, g/mol:	138.104465
ΔH_f, kcal/mol:	-42.56
Dipole, Da:	4.08
IP(EA), eV:	-9.09(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-6-methoxyoct-1-en-7-yne

Drug info:

PubChemData

Smile

CC1=C(C(=O)CC2CCCC2=C1)C

DOS

IR

Vibrations