Geometry & MOs

Info

ID:	45708
PubChem CID:	10516726
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	278.188195
ΔH_f, kcal/mol:	-166.63
Dipole, Da:	3.71
IP(EA), eV:	-9.59(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1Z,3E)-3-methyl-5-(oxan-2-yloxy)penta-1,3-dienyl]cyclohex-2-en-1-ol

Drug info:

PubChemData

Smile

CCCCCCC1(C2=C(C(=CC=C2)OC)C(=O)O1)OC

DOS

IR

Vibrations