Geometry & MOs

Info

ID:	248137
PubChem CID:	103079218
Reduced:	N3O4C13H17 (1)
Stoich.:	A3B4C13D17 (1)
Weight, g/mol:	284.9913
ΔH_f, kcal/mol:	-70.94
Dipole, Da:	5.13
IP(EA), eV:	-8.34(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromo-2-fluorophenoxy)-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)OC2=CC(=C(C(=C2)OC)OC)OC)N

DOS

IR

Vibrations