Geometry & MOs

Info

ID:	253520
PubChem CID:	103118970
Reduced:	O2N4C11H20 (1)
Stoich.:	A2B4C11D20 (1)
Weight, g/mol:	283.075705
ΔH_f, kcal/mol:	-66.59
Dipole, Da:	6.46
IP(EA), eV:	-10.1(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-3-pyrazolo[1,5-a]pyrazin-3-ylpropane-1,3-dione

Drug info:

PubChemData

Smile

CC(C)(C)CCN1C(=C(N=N1)C(=O)O)CCN

DOS

IR

Vibrations