Geometry & MOs

Info

ID:	125484
PubChem CID:	50926075
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	391.144453
ΔH_f, kcal/mol:	-0.61
Dipole, Da:	2.96
IP(EA), eV:	-8.77(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-ethylphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(2-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CCCCN(C)C(=O)CN1C(=O)C2=CC(=NN2C=N1)C3=CC=C(C=C3)CC

DOS

IR

Vibrations