Geometry & MOs

Info

ID:	337992
PubChem CID:	127258615
Reduced:	O2C15H28 (1)
Stoich.:	A2B15C28 (1)
Weight, g/mol:	250.19328
ΔH_f, kcal/mol:	-140.69
Dipole, Da:	1.39
IP(EA), eV:	-9.09(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methyl-3-(4-methylcyclohex-3-en-1-yl)but-3-enyl] butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC(C)C(C)CCC=C(C)C

DOS

IR

Vibrations