Geometry & MOs

Info

ID:	151168
PubChem CID:	53790868
Reduced:	NO4C28H31 (1)
Stoich.:	AB4C28D31 (1)
Weight, g/mol:	214.088832
ΔH_f, kcal/mol:	-102.73
Dipole, Da:	2.98
IP(EA), eV:	-8.87(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2-[2-(1H-imidazol-5-yl)ethyl]-4-methyl-1,2,5-thiadiazolidine 1-oxide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C#CC2(CCCC(=O)C2)C3=CC(=CC=C3)OCOC4CCCC4

DOS

IR

Vibrations