Geometry & MOs

Info

ID:	12256
PubChem CID:	133614
Reduced:	ClSN2O2C9H11 (1)
Stoich.:	ABC2D2E9F11 (1)
Weight, g/mol:	246.022976
ΔH_f, kcal/mol:	-59.81
Dipole, Da:	5.06
IP(EA), eV:	-9.38(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

Drug info:

PubChemData

Smile

C1CNCC2=C1C=CC(=C2Cl)S(=O)(=O)N

DOS

IR

Vibrations