Geometry & MOs

Info

ID:	209456
PubChem CID:	80676051
Reduced:	BrClSN2O2C12H16 (1)
Stoich.:	ABCD2E2F12G16 (1)
Weight, g/mol:	292.98336
ΔH_f, kcal/mol:	-62.01
Dipole, Da:	3.98
IP(EA), eV:	-9.21(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1-(1H-imidazol-5-ylsulfonyl)piperidine

Drug info:

PubChemData

Smile

C1CN(CCN1CCBr)S(=O)(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations