Geometry & MOs

Info

ID:

192691

PubChem CID:

78302670

Reduced:

NO4C19H21 (1)

Stoich.:

AB4C19D21 (1)

Weight, g/mol:

473.168581

ΔHf, kcal/mol:

-54.28

Dipole, Da:

3.35

IP(EA), eV:

 -8.72(-0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-2,9-dihydroxy-17-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,5,8-tetraene-4,7,13-trione

Drug info:

PubChemData

Smile

C=CCN1CCC23C4C1CC5=C2C(=C(C=C5)O)OC3C(C6C4O6)O

DOS

IR

Vibrations