Geometry & MOs

Info

ID:

411452

PubChem CID:

135084283

Reduced:

NOC12H13 (1)

Stoich.:

ABC12D13 (1)

Weight, g/mol:

291.89214

ΔHf, kcal/mol:

59.5

Dipole, Da:

1.9

IP(EA), eV:

-9.44(0.1)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(1,2-dibromoethenyl)-4-methoxybenzene

Drug info:

PubChemData

Smile

C#CCNC[C@@H]1[C@H](O1)C2=CC=CC=C2

DOS

IR

Vibrations