Geometry & MOs

Info

ID:

403705

PubChem CID:

135061485

Reduced:

NO3H19C22 (1)

Stoich.:

AB3C19D22 (1)

Weight, g/mol:

345.136493

ΔHf, kcal/mol:

32.73

Dipole, Da:

6.5

IP(EA), eV:

-9.61(-1.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-nitro-4-[2-phenyl-1-(1-phenylethoxy)ethenyl]benzene

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)OC(=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

DOS

IR

Vibrations