Geometry & MOs

Info

ID:

410861

PubChem CID:

135083662

Reduced:

PN2O2C10H14 (1)

Stoich.:

AB2C2D10E14 (1)

Weight, g/mol:

154.135765

ΔHf, kcal/mol:

-19.51

Dipole, Da:

2.19

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.881024

Charge, e:

 0

Chem-info

IUPAC name:

(E)-1-cyclopentyl-2-methylbut-2-en-1-ol

Drug info:

PubChemData

Smile

CCO/C(=C(\[N+]#N)/P1C=C(C(=C1)C)C)/O

DOS

IR

Vibrations