Geometry & MOs

Info

ID:	207486
PubChem CID:	80403180
Reduced:	SN3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	266.04186
ΔH_f, kcal/mol:	-2.98
Dipole, Da:	4.06
IP(EA), eV:	-8.65(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromopyridin-2-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C(C)C)NCC2CCCS2

DOS

IR

Vibrations