Geometry & MOs

Info

ID:

163958

PubChem CID:

74381073

Reduced:

O2N6C25H34 (1)

Stoich.:

A2B6C25D34 (1)

Weight, g/mol:

776.482311

ΔHf, kcal/mol:

-5.02

Dipole, Da:

7.35

IP(EA), eV:

 -8.52(-0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[5-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-11-ethyl-4,12-dihydroxy-2,4,6,8,12,19-hexamethyl-16-methylidene-9-oxo-10,14-dioxa-1-azabicyclo[11.4.2]nonadecan-7-yl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2C3CCC(CC3NN2)NC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

DOS

IR

Vibrations