Geometry & MOs

Info

ID:	73975
PubChem CID:	48421301
Reduced:	ON2C6H8 (3)
Stoich.:	AB2C6D8 (3)
Weight, g/mol:	345.125946
ΔH_f, kcal/mol:	-101.21
Dipole, Da:	5.1
IP(EA), eV:	-8.34(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-yl)-3-(2-oxoimidazolidin-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)NC2=CC(=CC=C2)N3CCNC3=O)N4CCNC4=O

DOS

IR

Vibrations