Geometry & MOs

Info

ID:	55135
PubChem CID:	17389806
Reduced:	BrClNSC9H13 (1)
Stoich.:	ABCDE9F13 (1)
Weight, g/mol:	244.98738
ΔH_f, kcal/mol:	-14.62
Dipole, Da:	3.35
IP(EA), eV:	-9.1(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromothiophen-2-yl)piperidine

Drug info:

PubChemData

Smile

C1CCNC(C1)C2=CC(=CS2)Br.Cl

DOS

IR

Vibrations