Geometry & MOs

Info

ID:	404011
PubChem CID:	135064373
Reduced:	NSC19H27 (1)
Stoich.:	ABC19D27 (1)
Weight, g/mol:	386.163043
ΔH_f, kcal/mol:	7.16
Dipole, Da:	0.64
IP(EA), eV:	-9.03(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxy-3-(4-methylphenyl)-1-oxo-N-phenyl-3-phenyliminopropan-2-imine oxide

Drug info:

PubChemData

Smile

CCCCCCCCCCC1=CSC(=N1)C2=CC=CC=C2

DOS

IR

Vibrations