Geometry & MOs

Info

ID:	280975
PubChem CID:	103852289
Reduced:	NOBr2S2C10H11 (1)
Stoich.:	ABC2D2E10F11 (1)
Weight, g/mol:	332.95898
ΔH_f, kcal/mol:	3.2
Dipole, Da:	2.31
IP(EA), eV:	-8.82(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-methyl-N-(thiolan-3-yl)benzamide

Drug info:

PubChemData

Smile

CN(C1CCSC1)C(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations