Geometry & MOs

Info

ID:	410418
PubChem CID:	135083214
Reduced:	ClH2N2Se2C4 (2)
Stoich.:	AB2C2D2E4 (2)
Weight, g/mol:	336.84242
ΔH_f, kcal/mol:	183.16
Dipole, Da:	0.45
IP(EA), eV:	-8.66(-2.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-chloro-1lambda4,2-diselena-3,5-diazacyclopenta-3,5-dien-4-yl)benzonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C2=N[Se][Se](=N2)Cl)C3=N[Se][Se](=N3)Cl

DOS

IR

Vibrations