Geometry & MOs

Info

ID:

436795

PubChem CID:

135211592

Reduced:

ClON4C16H22 (1)

Stoich.:

ABC4D16E22 (1)

Weight, g/mol:

270.064057

ΔHf, kcal/mol:

69.23

Dipole, Da:

2.73

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 2.328480

Charge, e:

0

Chem-info

IUPAC name:

3,6-bis(furan-2-yl)-1-hydroxy-2,5-dihydro-1H-pyrrolo[3,4-c]pyrrol-4-one

Drug info:

PubChemData

Smile

CC/C(=C/1\C=C(C=C(N1N)NCC2=C[N+](=CC=C2)OC)Cl)/C

DOS

IR

Vibrations