Geometry & MOs

Info

ID:

47061

PubChem CID:

10529240

Reduced:

O5C30H54 (1)

Stoich.:

A5B30C54 (1)

Weight, g/mol:

495.189317

ΔHf, kcal/mol:

-313.54

Dipole, Da:

4.06

IP(EA), eV:

 -8.8(1.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-hydroxy-2-[(4-phenyl-2,6,13,16,19-pentaoxatricyclo[18.4.0.07,12]tetracosa-1(24),7,9,11,20,22-hexaen-4-yl)oxy]acetamide

Drug info:

PubChemData

Smile

C[C@H](C[C@@H](CC(C)(C)O)O)C1=C2C[C@@H]([C@@H]3[C@@]([C@]2(CC1)C)(CCC([C@]3(C)CCO)C(C)(C)CO)C)O

DOS

IR

Vibrations