Geometry & MOs

Info

ID:	404537
PubChem CID:	135066695
Reduced:	NO2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	261.063722
ΔH_f, kcal/mol:	-106.97
Dipole, Da:	6.08
IP(EA), eV:	-8.99(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 6-(furan-2-yl)pyridine-3,4-dicarboxylate

Drug info:

PubChemData

Smile

CN1C=CC(=C1)C2=NC=C(C(=C2)C(=O)OC)C(=O)OC

DOS

IR

Vibrations