Geometry & MOs

Info

ID:	336885
PubChem CID:	127255892
Reduced:	NOBr3H10C14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	289.038473
ΔH_f, kcal/mol:	18.63
Dipole, Da:	6.93
IP(EA), eV:	-8.84(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;1-hydroxy-3-quinolin-6-ylpropane-1-sulfonate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)C/C(=C\2/C=CC(=CC2=O)Br)/N)Br

DOS

IR

Vibrations