Geometry & MOs

Info

ID:	365700
PubChem CID:	127318425
Reduced:	OSN4C15H16 (1)
Stoich.:	ABC4D15E16 (1)
Weight, g/mol:	331.099063
ΔH_f, kcal/mol:	71.95
Dipole, Da:	6.7
IP(EA), eV:	-8.98(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2-[[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3-benzoxazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)SCC3=NN=C(N3C)C4CC4

DOS

IR

Vibrations