Geometry & MOs

Info

ID:	253259
PubChem CID:	103117197
Reduced:	O3N4C13H16 (1)
Stoich.:	A3B4C13D16 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	-73.04
Dipole, Da:	6.07
IP(EA), eV:	-9.88(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(pyrazolo[1,5-a]pyrazine-3-carbonyl)piperidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)O)NC(=O)C1=C2C=NC=CN2N=C1

DOS

IR

Vibrations