Geometry & MOs

Info

ID:	253204
PubChem CID:	103116767
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	291.085521
ΔH_f, kcal/mol:	-106.83
Dipole, Da:	4.92
IP(EA), eV:	-9.56(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-methoxy-4-oxo-2-(pyrazolo[1,5-a]pyridine-3-carbonylamino)butanoic acid

Drug info:

PubChemData

Smile

CCCC1(CCCN(C1)C(=O)C2=NN(C=C2)C)C(=O)O

DOS

IR

Vibrations