Geometry & MOs

Info

ID:

180396

PubChem CID:

76627556

Reduced:

NOC24H33 (1)

Stoich.:

ABC24D33 (1)

Weight, g/mol:

846.545305

ΔHf, kcal/mol:

-9.54

Dipole, Da:

2.59

IP(EA), eV:

 -8.28(0.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-[[6-[3-(dimethylamino)-4-[2-hydroxyethyl(methyl)amino]-6-methyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-4-yl]oxy]-4-methoxy-2,4-dimethyloxan-3-yl] acetate

Drug info:

PubChemData

Smile

CC(C)N(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)C=C)OC)C(C)C

DOS

IR

Vibrations