Geometry & MOs

Info

ID:

376634

PubChem CID:

134222655

Reduced:

FO3N4C34H41 (1)

Stoich.:

AB3C4D34E41 (1)

Weight, g/mol:

369.230394

ΔHf, kcal/mol:

-137.99

Dipole, Da:

9.42

IP(EA), eV:

 -9.09(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(7R,8S,12S,13S)-7-[cyclopropylmethyl(ethyl)amino]-13-ethyl-11-methylidene-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14)-triene-2,8-diol

Drug info:

PubChemData

Smile

CCC(=O)N(C)C1CCC(CC1)CC(=O)NC2=CC(=C(N=C2)C3=CC(=C(C=C3)C4(CC(C4)(C)O)N)F)C5=CC=CC=C5

DOS

IR

Vibrations