Geometry & MOs

Info

ID:	349047
PubChem CID:	127274773
Reduced:	NSO4C13H23 (1)
Stoich.:	ABC4D13E23 (1)
Weight, g/mol:	387.198048
ΔH_f, kcal/mol:	-190.44
Dipole, Da:	0.51
IP(EA), eV:	-8.73(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzothiazol-2-yl)-N-(2-cyclohexyloxyethyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CSCC(=O)NCC2COCCO2

DOS

IR

Vibrations