Geometry & MOs

Info

ID:	369288
PubChem CID:	127332276
Reduced:	BrNSO2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	289.97246
ΔH_f, kcal/mol:	-62.92
Dipole, Da:	4.78
IP(EA), eV:	-9.54(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-3,4-dihydro-1H-isoquinoline-2-sulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCC2=C(C1)C(=CC=C2)Br

DOS

IR

Vibrations