Geometry & MOs

Info

ID:

345599

PubChem CID:

127269899

Reduced:

O2N4C21H36 (1)

Stoich.:

A2B4C21D36 (1)

Weight, g/mol:

280.189926

ΔHf, kcal/mol:

-124.28

Dipole, Da:

6.25

IP(EA), eV:

-8.84(0.93)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)N2CCN(CC2)C(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations