Geometry & MOs

Info

ID:

142306

PubChem CID:

53013601

Reduced:

N3O3H15C16 (1)

Stoich.:

A3B3C15D16 (1)

Weight, g/mol:

267.11201

ΔHf, kcal/mol:

13.17

Dipole, Da:

2.07

IP(EA), eV:

-8.41(-0.98)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,N-dimethyl-4-(5-pyrazin-2-yl-1,2,4-oxadiazol-3-yl)aniline

Drug info:

PubChemData

Smile

C1COCCN1C2=CC=C(C=C2)C3=NOC(=N3)C4=CC=CO4

DOS

IR

Vibrations