Geometry & MOs

Info

ID:	292621
PubChem CID:	117356030
Reduced:	ClFON3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	241.041818
ΔH_f, kcal/mol:	-30.04
Dipole, Da:	3.18
IP(EA), eV:	-8.61(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-2-fluoro-4-methoxyphenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C2=CC(=NN2)N)Cl)F

DOS

IR

Vibrations