Geometry & MOs

Info

ID:	256629
PubChem CID:	103140324
Reduced:	BrFN4C11H12 (1)
Stoich.:	ABC4D11E12 (1)
Weight, g/mol:	345.02769
ΔH_f, kcal/mol:	38.63
Dipole, Da:	6.32
IP(EA), eV:	-9.59(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(C2=CC(=CC(=C2)Br)F)NN

DOS

IR

Vibrations