Geometry & MOs

Info

ID:	207197
PubChem CID:	80359680
Reduced:	ON2C6H7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	296.084017
ΔH_f, kcal/mol:	-22.6
Dipole, Da:	3.4
IP(EA), eV:	-8.57(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylpyrazol-3-yl)-2-(2-chloro-6-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)N)NC(=O)CC2=CC(=CC=C2)O

DOS

IR

Vibrations