Geometry & MOs

Info

ID:	256630
PubChem CID:	103140325
Reduced:	BrFN3H13C16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	258.184447
ΔH_f, kcal/mol:	48.98
Dipole, Da:	3.7
IP(EA), eV:	-9.59(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydrazinyl-1-isoquinolin-8-yl-N,N,2-trimethylpropan-2-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C=NC=C2)C(=C1)C(C3=CC(=CC(=C3)Br)F)NN

DOS

IR

Vibrations