Geometry & MOs

Info

ID:	248111
PubChem CID:	103079002
Reduced:	ClN5C7H8 (1)
Stoich.:	AB5C7D8 (1)
Weight, g/mol:	240.99631
ΔH_f, kcal/mol:	87.99
Dipole, Da:	5.49
IP(EA), eV:	-8.4(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromopyrazol-1-yl)-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)N2C=C(C=N2)Cl)N

DOS

IR

Vibrations