Geometry & MOs

Info

ID:	449854
PubChem CID:	135302127
Reduced:	NOC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	-44.98
Dipole, Da:	2.21
IP(EA), eV:	-9.39(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5-tert-butylpyrazin-2-yl)oxymethyl]-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN=C(C=N1)OCC2COC2

DOS

IR

Vibrations