Geometry & MOs

Info

ID:	327343
PubChem CID:	126689614
Reduced:	O7C11H14 (1)
Stoich.:	A7B11C14 (1)
Weight, g/mol:	211.059306
ΔH_f, kcal/mol:	-282.04
Dipole, Da:	3.49
IP(EA), eV:	-10.2(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-hydroxy-4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-2-carboxylate

Drug info:

PubChemData

Smile

C/C(=C\C(=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O)/C(=O)O

DOS

IR

Vibrations