Geometry & MOs

Info

ID:	2918
PubChem CID:	8834
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-130.24
Dipole, Da:	1.82
IP(EA), eV:	-9.2(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-dimethyloct-6-enyl propanoate

Drug info:

PubChemData

Smile

CCC(=O)OCCC(C)CCC=C(C)C

DOS

IR

Vibrations