Geometry & MOs

Info

ID:	226568
PubChem CID:	87544188
Reduced:	NSO4C12H13 (1)
Stoich.:	ABC4D12E13 (1)
Weight, g/mol:	257.114386
ΔH_f, kcal/mol:	-113.78
Dipole, Da:	6.35
IP(EA), eV:	-9.23(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C=C=O

DOS

IR

Vibrations