Geometry & MOs

Info

ID:

15437

PubChem CID:

441759

Reduced:

NO3C22H27 (1)

Stoich.:

AB3C22D27 (1)

Weight, g/mol:

353.199094

ΔHf, kcal/mol:

-88.39

Dipole, Da:

1.28

IP(EA), eV:

 -9.25(0.3)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,5S,11S,14R,17S,20S,21R)-5-methyl-15-methylidene-7-oxa-10-azaheptacyclo[12.6.2.01,11.05,20.06,10.012,17.017,21]docosane-19,22-dione

Drug info:

PubChemData

Smile

C[C@]12CCC[C@]34[C@@H]1C(=O)C[C@]56[C@H]3C(=O)[C@H](CC5[C@@H]4N7C2OCC7)C(=C)C6

DOS

IR

Vibrations