Geometry & MOs

Info

ID:

302818

PubChem CID:

124396827

Reduced:

NO4H25C34 (1)

Stoich.:

AB4C25D34 (1)

Weight, g/mol:

260.043321

ΔHf, kcal/mol:

-4.71

Dipole, Da:

7.26

IP(EA), eV:

-8.1(-1.3)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[(Z)-2-nitroethenyl]-5-(4-nitrophenyl)furan

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)[C@@H]2[C@@H](C3([C@@H]4N2C5=CC=CC=C5C=C4)C(=O)C6=CC=CC=C6C3=O)C7=CC=CC=C7

DOS

IR

Vibrations