Geometry & MOs

Info

ID:	256828
PubChem CID:	103141685
Reduced:	SO2N4H12C14 (1)
Stoich.:	AB2C4D12E14 (1)
Weight, g/mol:	345.02769
ΔH_f, kcal/mol:	73.32
Dipole, Da:	8.96
IP(EA), eV:	-9.21(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2-bromo-5-fluorophenyl)-isoquinolin-8-ylmethyl]hydrazine

Drug info:

PubChemData

Smile

C1=CC(=C2C=CN=CC2=C1NCCC3=NC=CS3)[N+](=O)[O-]

DOS

IR

Vibrations