Geometry & MOs

Info

ID:

333888

PubChem CID:

127252440

Reduced:

O3N4C16H30 (1)

Stoich.:

A3B4C16D30 (1)

Weight, g/mol:

388.166604

ΔHf, kcal/mol:

-138.85

Dipole, Da:

3.39

IP(EA), eV:

-8.7(0.68)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[(4aS,8aS)-5-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-4a-methyl-3,4,6,7,8,8a-hexahydro-2H-1,5-naphthyridin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCN(C1)[C@@H]2CN(C[C@H]2O)C(=O)CN3CCN(CC3)CCO

DOS

IR

Vibrations