Geometry & MOs

Info

ID:

409331

PubChem CID:

135082111

Reduced:

OC10H17 (1)

Stoich.:

AB10C17 (1)

Weight, g/mol:

122.049782

ΔHf, kcal/mol:

-44.65

Dipole, Da:

1.92

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.906048

Charge, e:

 1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]([C@@H](C1)O)C(=C)[CH2]

DOS

IR

Vibrations