Geometry & MOs

Info

ID:	292623
PubChem CID:	117356035
Reduced:	ClFON3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	241.041818
ΔH_f, kcal/mol:	-25.41
Dipole, Da:	2.02
IP(EA), eV:	-8.83(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-chloro-3-fluoro-2-methoxyphenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)C2=CC(=NN2)N)Cl)F

DOS

IR

Vibrations