Geometry & MOs

Info

ID:

192

PubChem CID:

2269

Reduced:

NO6C19H36 (2)

Stoich.:

AB6C19D36 (2)

Weight, g/mol:

748.508526

ΔHf, kcal/mol:

-614.68

Dipole, Da:

5.86

IP(EA), eV:

 -8.57(0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one

Drug info:

PubChemData

Smile

CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O

DOS

IR

Vibrations