Geometry & MOs

Info

ID:	174829
PubChem CID:	75820267
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	284.033444
ΔH_f, kcal/mol:	-81.9
Dipole, Da:	5.33
IP(EA), eV:	-8.36(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[(5-chlorothiophen-2-yl)methyl]-2-thiophen-3-ylpyrrolidin-1-ium

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C)NC(=O)NC2=C(C=CC(=C2)NC(=O)C)C

DOS

IR

Vibrations