Geometry & MOs

Info

ID:	8299
PubChem CID:	76105
Reduced:	SN2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	218.08777
ΔH_f, kcal/mol:	34.34
Dipole, Da:	2.5
IP(EA), eV:	-8.55(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-yl-1,3-benzothiazole

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations