Geometry & MOs

Info

ID:	253572
PubChem CID:	103119329
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	-28.99
Dipole, Da:	2.62
IP(EA), eV:	-9.33(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentane-1,3-dione

Drug info:

PubChemData

Smile

CC(C)C(=O)CC(=O)C1=C2C=CC=CN2N=C1

DOS

IR

Vibrations