Geometry & MOs

Info

ID:	447774
PubChem CID:	135285562
Reduced:	ON4H24C26 (1)
Stoich.:	AB4C24D26 (1)
Weight, g/mol:	368.104859
ΔH_f, kcal/mol:	106.98
Dipole, Da:	7.38
IP(EA), eV:	-8.22(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexa-2,5-diene-1,4-dione;2,3-diphenylcyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2=CN=CC(=C2)C3=CC\4=C(C=C3)NN/C4=C\5/C=C6C=CC=CC6=N5

DOS

IR

Vibrations