Geometry & MOs

Info

ID:

396364

PubChem CID:

135028215

Reduced:

NOC4H8 (1)

Stoich.:

ABC4D8 (1)

Weight, g/mol:

202.153307

ΔHf, kcal/mol:

-16.18

Dipole, Da:

4.35

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754830

Charge, e:

 0

Chem-info

IUPAC name:

3,3-difluorododec-1-yne

Drug info:

PubChemData

Smile

CN(C)C(=O)[CH2+]

DOS

IR

Vibrations