Geometry & MOs

Info

ID:	253216
PubChem CID:	103116846
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	-65.98
Dipole, Da:	2.53
IP(EA), eV:	-9.54(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-6-(pyrazolo[1,5-a]pyrazine-3-carbonylamino)hexanoic acid

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)NCCC2=CC=CC=C2C(=O)O

DOS

IR

Vibrations