Geometry & MOs

Info

ID:	437839
PubChem CID:	135227125
Reduced:	SO2N4C23H28 (1)
Stoich.:	AB2C4D23E28 (1)
Weight, g/mol:	304.98853
ΔH_f, kcal/mol:	-7.36
Dipole, Da:	6.56
IP(EA), eV:	-8.5(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-fluorophenyl)-cyclopentyl-imino-oxo-lambda6-sulfane

Drug info:

PubChemData

Smile

CN1C=C(C2=C(C1=O)NC=C2)C3=C(C=CC(=C3)S(=N)(=O)C)NC4CCC5(CC4)CC5

DOS

IR

Vibrations