Geometry & MOs

Info

ID:	73517
PubChem CID:	48418013
Reduced:	ClOSN3H18C19 (1)
Stoich.:	ABCD3E18F19 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	16.5
Dipole, Da:	2.87
IP(EA), eV:	-8.71(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)C2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations