Geometry & MOs

Info

ID:	287549
PubChem CID:	104246863
Reduced:	ClNSO2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	259.043378
ΔH_f, kcal/mol:	-72.84
Dipole, Da:	7.45
IP(EA), eV:	-10.15(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloropropylsulfonyl)-6,7-dihydro-5H-cyclopenta[b]pyridine

Drug info:

PubChemData

Smile

C1CC2=C(C1)N=C(C=C2)S(=O)(=O)CCCl

DOS

IR

Vibrations