Geometry & MOs

Info

ID:	225479
PubChem CID:	85852493
Reduced:	NO2C12H21 (1)
Stoich.:	AB2C12D21 (1)
Weight, g/mol:	280.167459
ΔH_f, kcal/mol:	-76.0
Dipole, Da:	2.71
IP(EA), eV:	-10.78(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-ethenyldodeca-2,7-dienedioate

Drug info:

PubChemData

Smile

CCC(CC)(CC)C(C(=O)OCC)[N+]#[C-]

DOS

IR

Vibrations