Geometry & MOs

Info

ID:	254022
PubChem CID:	103122258
Reduced:	O2N4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	230.04399
ΔH_f, kcal/mol:	-52.67
Dipole, Da:	6.13
IP(EA), eV:	-10.33(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-pyrazolo[1,5-a]pyrazin-3-yl-1,3-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CCCC(CC1)N2C(=C(N=N2)C(=O)O)CN

DOS

IR

Vibrations