Geometry & MOs

Info

ID:	353181
PubChem CID:	127284361
Reduced:	SO2N4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	313.146013
ΔH_f, kcal/mol:	-15.25
Dipole, Da:	6.15
IP(EA), eV:	-8.61(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]-2-(oxan-2-ylmethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NC(=O)C2=CC=C(C=C2)CN3CCSCC3

DOS

IR

Vibrations