Geometry & MOs

Info

ID:	2205
PubChem CID:	6235
Reduced:	O2N3C12H13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	66.07
Dipole, Da:	1.65
IP(EA), eV:	-8.86(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,5-tris(aziridin-1-yl)cyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

C1CN1C2=CC(=O)C(=C(C2=O)N3CC3)N4CC4

DOS

IR

Vibrations