Geometry & MOs

Info

ID:	271986
PubChem CID:	103708480
Reduced:	OSN3C10H15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	314.00885
ΔH_f, kcal/mol:	-13.38
Dipole, Da:	5.84
IP(EA), eV:	-8.69(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(3-methylsulfanylcyclopentyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CSC1CCC(C1)NC(=O)C2=CNN=C2

DOS

IR

Vibrations