Geometry & MOs

Info

ID:

46469

PubChem CID:

10524564

Reduced:

FSO4C21H25 (1)

Stoich.:

ABC4D21E25 (1)

Weight, g/mol:

392.209993

ΔHf, kcal/mol:

-181.16

Dipole, Da:

6.62

IP(EA), eV:

 -9.79(-0.8)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 7-[(E)-hex-3-en-3-yl]-8-methyl-9-oxo-6,7,8,11-tetrahydro-5bH-indolizino[1,2-b]quinoline-6-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]35[C@@H](O5)C[C@@]2([C@]1(C(=O)S)O)C)C)F

DOS

IR

Vibrations