Geometry & MOs

Info

ID:

7588

PubChem CID:

73456

Reduced:

NO6C18H23 (1)

Stoich.:

AB6C18D23 (1)

Weight, g/mol:

349.152537

ΔHf, kcal/mol:

-187.85

Dipole, Da:

4.2

IP(EA), eV:

 -9.17(-0.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,5R,6R,7S,17R)-7-hydroxy-5,7-dimethyl-4-methylidenespiro[2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-6,2'-oxirane]-3,8-dione

Drug info:

PubChemData

Smile

C[C@@H]1C(=C)C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@@]([C@]14CO4)(C)O

DOS

IR

Vibrations