Geometry & MOs

Info

ID:

25050

PubChem CID:

617806

Reduced:

NO3H11C14 (1)

Stoich.:

AB3C11D14 (1)

Weight, g/mol:

241.073893

ΔHf, kcal/mol:

9.45

Dipole, Da:

8.35

IP(EA), eV:

-9.16(-1.4)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[2-(4-nitrophenyl)ethenyl]phenol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations