Geometry & MOs

Info

ID:	146142
PubChem CID:	53643296
Reduced:	O3C8H12 (1)
Stoich.:	A3B8C12 (1)
Weight, g/mol:	226.99795
ΔH_f, kcal/mol:	-118.68
Dipole, Da:	2.3
IP(EA), eV:	-10.5(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-butylethanesulfinamide

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1CCC1O

DOS

IR

Vibrations