Geometry & MOs

Info

ID:	370210
PubChem CID:	127337743
Reduced:	ON4C21H28 (1)
Stoich.:	AB4C21D28 (1)
Weight, g/mol:	395.130363
ΔH_f, kcal/mol:	-16.97
Dipole, Da:	4.93
IP(EA), eV:	-9.11(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-benzothiazol-2-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)NC3C(CC4=CC=CC=C34)C

DOS

IR

Vibrations