Geometry & MOs

Info

ID:	336280
PubChem CID:	127255287
Reduced:	O2N6C21H22 (1)
Stoich.:	A2B6C21D22 (1)
Weight, g/mol:	341.076018
ΔH_f, kcal/mol:	12.91
Dipole, Da:	4.59
IP(EA), eV:	-9.23(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(3-cyano-2-hydroxy-4-methyl-6-oxopyridin-1-yl)-3-oxo-2H-pyrazolo[4,3-c]pyridine-7-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NCCCC3=NN=C4N3C=CC=C4

DOS

IR

Vibrations