Geometry & MOs

Info

ID:

395859

PubChem CID:

135026737

Reduced:

OC15H17 (1)

Stoich.:

AB15C17 (1)

Weight, g/mol:

298.087495

ΔHf, kcal/mol:

-2.59

Dipole, Da:

1.36

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.113065

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C+](C)CC1=CC=C(C2=CC=CC=C12)OC

DOS

IR

Vibrations