Geometry & MOs

Info

ID:

380307

PubChem CID:

134970717

Reduced:

ON2C20H23 (1)

Stoich.:

AB2C20D23 (1)

Weight, g/mol:

280.01984

ΔHf, kcal/mol:

33.6

Dipole, Da:

4.26

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.756403

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(C(=C(C(N1[O])(C)C)C2=CC=CC=C2N)C3=CC=CC=C3)C

DOS

IR

Vibrations