Geometry & MOs

Info

ID:	413304
PubChem CID:	135086252
Reduced:	NSeO2C20H27 (1)
Stoich.:	ABC2D20E27 (1)
Weight, g/mol:	521.16217
ΔH_f, kcal/mol:	-40.49
Dipole, Da:	1.97
IP(EA), eV:	-8.51(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylselanyl-N-trityloct-2-yn-1-imine

Drug info:

PubChemData

Smile

CCCCC(C#CC=NC(C)CC(=O)OCC)[Se]C1=CC=CC=C1

DOS

IR

Vibrations