Geometry & MOs

Info

ID:	253750
PubChem CID:	103120387
Reduced:	N5O5C13H21 (1)
Stoich.:	A5B5C13D21 (1)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	-200.15
Dipole, Da:	6.68
IP(EA), eV:	-10.16(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxy-4-methylpiperidin-1-yl)-pyrazolo[1,5-a]pyrazin-3-ylmethanone

Drug info:

PubChemData

Smile

CC(=O)NCCN1C(=C(N=N1)C(=O)O)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations