Geometry & MOs

Info

ID:

412930

PubChem CID:

135085867

Reduced:

NOC11H15 (1)

Stoich.:

ABC11D15 (1)

Weight, g/mol:

280.04628

ΔHf, kcal/mol:

-14.01

Dipole, Da:

1.44

IP(EA), eV:

-9.14(-0.18)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2-bromocyclohex-2-en-1-yl)oxy-3-ethylbenzene

Drug info:

PubChemData

Smile

CC(C)C1=NC=C(C=C1)OC(=C)C

DOS

IR

Vibrations