Geometry & MOs

Info

ID:

204273

PubChem CID:

79939974

Reduced:

NC3H5 (4)

Stoich.:

AB3C5 (4)

Weight, g/mol:

238.204513

ΔHf, kcal/mol:

41.43

Dipole, Da:

2.96

IP(EA), eV:

-8.02(0.9)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-ethyl-2-(oxan-4-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)N2CCN3CCCC3C2

DOS

IR

Vibrations