Geometry & MOs

Info

ID:	349038
PubChem CID:	127274764
Reduced:	OSN6C20H24 (1)
Stoich.:	ABC6D20E24 (1)
Weight, g/mol:	373.182398
ΔH_f, kcal/mol:	37.61
Dipole, Da:	8.32
IP(EA), eV:	-8.47(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=NN=C(N2C1)CCNC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations