Geometry & MOs

Info

ID:	345865
PubChem CID:	127270165
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	389.123169
ΔH_f, kcal/mol:	-46.39
Dipole, Da:	1.04
IP(EA), eV:	-8.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]-1,3-benzothiazole-6-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1C(=O)N2CCSCC2)NC(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations