Geometry & MOs

Info

ID:	73485
PubChem CID:	48417881
Reduced:	SO2N3H23C24 (1)
Stoich.:	AB2C3D23E24 (1)
Weight, g/mol:	381.151098
ΔH_f, kcal/mol:	0.15
Dipole, Da:	2.25
IP(EA), eV:	-8.6(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2-phenoxypropanamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)COC2=CC3=CC=CC=C3C=C2)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations