Geometry & MOs

Info

ID:	411218
PubChem CID:	135084031
Reduced:	SeN3O5C9H13 (1)
Stoich.:	AB3C5D9E13 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-187.89
Dipole, Da:	3.91
IP(EA), eV:	-9.04(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,8S,9R)-1,12,12-trimethyl-3-oxa-5lambda6-thia-4-azatetracyclo[7.2.1.02,4.02,8]dodecane 5,5-dioxide

Drug info:

PubChemData

Smile

C(C1C(C(C(O1)C2=NC(=C([Se]2)N)C(=O)N)O)O)O

DOS

IR

Vibrations