Geometry & MOs

Info

ID:	17764
PubChem CID:	517746
Reduced:	NO2C5H7 (2)
Stoich.:	AB2C5D7 (2)
Weight, g/mol:	226.095357
ΔH_f, kcal/mol:	-138.84
Dipole, Da:	2.25
IP(EA), eV:	-10.32(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 1-methylpyrazole-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=NN1C)C(=O)OCC

DOS

IR

Vibrations