Geometry & MOs

Info

ID:	399025
PubChem CID:	135037129
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	237.115364
ΔH_f, kcal/mol:	-159.39
Dipole, Da:	3.98
IP(EA), eV:	-8.65(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-N-[(E)-3-phenylprop-2-enyl]methanimine oxide

Drug info:

PubChemData

Smile

CCN1C[C@H]2CCC[C@@](C1)(C2O)C(=O)OCC

DOS

IR

Vibrations