Geometry & MOs

Info

ID:	124547
PubChem CID:	50887212
Reduced:	ISN3O5C20H20 (1)
Stoich.:	ABC3D5E20F20 (1)
Weight, g/mol:	345.172879
ΔH_f, kcal/mol:	-82.35
Dipole, Da:	12.45
IP(EA), eV:	-8.88(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-ethoxy-4-(2-phenylethoxy)phenyl]-N-phenylmethanimine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1I)/C=C\2/C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C)OC

DOS

IR

Vibrations