Geometry & MOs

Info

ID:	287547
PubChem CID:	104246801
Reduced:	N3C13H19 (1)
Stoich.:	A3B13C19 (1)
Weight, g/mol:	241.069198
ΔH_f, kcal/mol:	30.9
Dipole, Da:	1.94
IP(EA), eV:	-8.15(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorobutan-2-ylsulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridine

Drug info:

PubChemData

Smile

C1CCN(CC1)NC2=NC3=C(CCC3)C=C2

DOS

IR

Vibrations