Geometry & MOs

Info

ID:	137795
PubChem CID:	52264447
Reduced:	N2O5C21H24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	350.13789
ΔH_f, kcal/mol:	-177.29
Dipole, Da:	8.29
IP(EA), eV:	-9.23(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-methoxypyridin-3-yl)-2-oxoacetamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNC(=O)COC2=CC=CC=C2CNC(=O)C3=CC=CC=C3O

DOS

IR

Vibrations