Geometry & MOs

Info

ID:	253595
PubChem CID:	103119467
Reduced:	NO2C5H6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	260.079707
ΔH_f, kcal/mol:	-105.86
Dipole, Da:	6.86
IP(EA), eV:	-10.11(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-methyl-2,4-dioxo-4-pyrazolo[1,5-a]pyridin-3-ylbutanoate

Drug info:

PubChemData

Smile

CC(C(=O)C1=NN(C=C1)C)C(=O)C(=O)OC

DOS

IR

Vibrations