Geometry & MOs

Info

ID:	405403
PubChem CID:	135073827
Reduced:	OSiC19H26 (1)
Stoich.:	ABC19D26 (1)
Weight, g/mol:	259.120843
ΔH_f, kcal/mol:	6.96
Dipole, Da:	2.25
IP(EA), eV:	-9.2(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E,2Z)-2-[amino(phenyl)methylidene]-5-oxohex-3-enoate

Drug info:

PubChemData

Smile

CCCCC1=C(C1C(C#CC2=CC=CC=C2)O)[Si](C)(C)C

DOS

IR

Vibrations