Geometry & MOs

Info

ID:	287367
PubChem CID:	104239347
Reduced:	NSO2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	248.028935
ΔH_f, kcal/mol:	-87.67
Dipole, Da:	2.82
IP(EA), eV:	-9.37(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1(CC(C2=C(C1)N=C(S2)CO)O)C

DOS

IR

Vibrations