Geometry & MOs

Info

ID:	413303
PubChem CID:	135086251
Reduced:	SiO2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	393.1207
ΔH_f, kcal/mol:	-32.79
Dipole, Da:	2.48
IP(EA), eV:	-8.88(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(4-phenylselanyloct-2-ynylideneamino)butanoate

Drug info:

PubChemData

Smile

C[Si](C)(C)C#CC(C1=CC=CC=C1)(C2=CC=C(C=C2)O)O

DOS

IR

Vibrations