Geometry & MOs

Info

ID:	52552
PubChem CID:	12015465
Reduced:	N2O2H8C9 (1)
Stoich.:	A2B2C8D9 (1)
Weight, g/mol:	242.079038
ΔH_f, kcal/mol:	15.69
Dipole, Da:	3.59
IP(EA), eV:	-9.79(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4,5-dimethoxycyclopenta-3,5-diene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

COC1=C(CC(=C1OC)C#N)C#N

DOS

IR

Vibrations