Geometry & MOs

Info

ID:

230808

PubChem CID:

87572043

Reduced:

O13C55H108 (1)

Stoich.:

A13B55C108 (1)

Weight, g/mol:

338.269928

ΔHf, kcal/mol:

-778.79

Dipole, Da:

4.17

IP(EA), eV:

 -9.68(0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@H](CCC[C@H](C)CCCC(C)C)CCC[C@@H](C)CCOC[C@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)OCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C

DOS

IR

Vibrations