Geometry & MOs

Info

ID:	253549
PubChem CID:	103119154
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	-35.02
Dipole, Da:	5.43
IP(EA), eV:	-8.89(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)CC(=O)C1=NN(C2=CC=CC=C21)C

DOS

IR

Vibrations