Geometry & MOs

Info

ID:	73483
PubChem CID:	48417876
Reduced:	OSN3C19H23 (1)
Stoich.:	ABC3D19E23 (1)
Weight, g/mol:	366.151433
ΔH_f, kcal/mol:	0.6
Dipole, Da:	2.61
IP(EA), eV:	-8.63(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C=C1)CC(=O)NC2CCN(CC2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations