Geometry & MOs

Info

ID:	144409
PubChem CID:	53364492
Reduced:	ON4C28H28 (1)
Stoich.:	AB4C28D28 (1)
Weight, g/mol:	238.074228
ΔH_f, kcal/mol:	77.42
Dipole, Da:	4.0
IP(EA), eV:	-8.84(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-diphenyl-2,6-dioxa-1,3-diazabicyclo[3.1.0]hex-3-ene

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCC2=CC=CC=C2)C(=O)N3C=C(N=N3)C4=CC=C(C=C4)C5=CC=CC=C5

DOS

IR

Vibrations