Geometry & MOs

Info

ID:	269582
PubChem CID:	103618041
Reduced:	SN2O3H10C15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	271.077933
ΔH_f, kcal/mol:	-43.53
Dipole, Da:	3.28
IP(EA), eV:	-9.15(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-6-yl)-1-cyanocyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C2)N=CS3)C(=O)O

DOS

IR

Vibrations