Geometry & MOs

Info

ID:	343239
PubChem CID:	127266412
Reduced:	SO2N3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	333.089561
ΔH_f, kcal/mol:	-43.17
Dipole, Da:	4.94
IP(EA), eV:	-9.26(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethyl-6-methyl-4-oxo-1H-pyrazolo[4,3-c]pyridin-3-yl)-3-methoxy-1,2-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)NCCN1C=NC=CC1=O)SC2=CC=CC=C2

DOS

IR

Vibrations