Geometry & MOs

Info

ID:	73482
PubChem CID:	48417874
Reduced:	OSN5C23H23 (1)
Stoich.:	ABC5D23E23 (1)
Weight, g/mol:	341.156184
ΔH_f, kcal/mol:	64.74
Dipole, Da:	2.37
IP(EA), eV:	-8.67(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2-cyclopent-2-en-1-ylacetamide

Drug info:

PubChemData

Smile

CC1=CC=NN1C2=CC=C(C=C2)C(=O)NC3CCN(CC3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations