Geometry & MOs

Info

ID:	50644
PubChem CID:	12013209
Reduced:	OH24C25 (1)
Stoich.:	AB24C25 (1)
Weight, g/mol:	188.120115
ΔH_f, kcal/mol:	120.95
Dipole, Da:	1.14
IP(EA), eV:	-8.99(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2E,4E)-hexa-2,4-dienoxy]hepta-1,6-diyne

Drug info:

PubChemData

Smile

C/C=C/C=C/COC(CCC#CC1=CC=CC=C1)C#CC2=CC=CC=C2

DOS

IR

Vibrations