Geometry & MOs

Info

ID:	59223
PubChem CID:	24775783
Reduced:	OC11H16 (1)
Stoich.:	AB11C16 (1)
Weight, g/mol:	254.167065
ΔH_f, kcal/mol:	11.25
Dipole, Da:	2.31
IP(EA), eV:	-9.36(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-methyl-5-[(Z)-3-methylpent-2-en-4-ynoxy]pent-3-enyl]benzene

Drug info:

PubChemData

Smile

CC(=CCOC/C=C(/C)\C#C)C

DOS

IR

Vibrations