Geometry & MOs

Info

ID:	284196
PubChem CID:	104038320
Reduced:	BrFN4H10C11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	325.990821
ΔH_f, kcal/mol:	30.32
Dipole, Da:	1.92
IP(EA), eV:	-9.01(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-(2-hydrazinylpyridin-4-yl)-8lambda4-thia-7,9-diazabicyclo[4.3.0]nona-1(6),2,4,7,8-pentaen-2-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC2=CC(=NC=C2)NN)F)Br

DOS

IR

Vibrations