Geometry & MOs

Info

ID:	368323
PubChem CID:	127327916
Reduced:	O2N3C21H33 (1)
Stoich.:	A2B3C21D33 (1)
Weight, g/mol:	333.151098
ΔH_f, kcal/mol:	-94.62
Dipole, Da:	3.64
IP(EA), eV:	-8.72(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-1,3-benzothiazole-6-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)CC(CNC(=O)C(C)N2CCC3=CC=CC=C3C2)O

DOS

IR

Vibrations