Geometry & MOs

Info

ID:

12008

PubChem CID:

125866

Reduced:

NO3C21H35 (1)

Stoich.:

AB3C21D35 (1)

Weight, g/mol:

349.261694

ΔHf, kcal/mol:

-180.63

Dipole, Da:

7.65

IP(EA), eV:

 -9.47(0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,2R,7R,10S,11S,14R,15S)-14-[(2S)-1-hydroxypropan-2-yl]-2,6,15-trimethyl-4-oxa-6-azatetracyclo[8.7.0.02,7.011,15]heptadecan-5-one

Drug info:

PubChemData

Smile

C[C@H](CO)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(COC(=O)N4C)C)C

DOS

IR

Vibrations