Geometry & MOs

Info

ID:	556
PubChem CID:	2985
Reduced:	O2C17H24 (1)
Stoich.:	A2B17C24 (1)
Weight, g/mol:	260.17763
ΔH_f, kcal/mol:	6.1
Dipole, Da:	3.74
IP(EA), eV:	-10.1(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptadeca-9,16-dien-4,6-diyne-3,8-diol

Drug info:

PubChemData

Smile

CCC(C#CC#CC(C=CCCCCCC=C)O)O

DOS

IR

Vibrations