Geometry & MOs

Info

ID:	227706
PubChem CID:	87562270
Reduced:	F2O3N7C28H37 (1)
Stoich.:	A2B3C7D28E37 (1)
Weight, g/mol:	321.116507
ΔH_f, kcal/mol:	-139.97
Dipole, Da:	7.22
IP(EA), eV:	-8.76(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-1-(4-phenylmethoxyphenyl)methanimine oxide

Drug info:

PubChemData

Smile

C[C@@H]1CCC(C1)N2CC(C(=O)N(C3=CN=C(N=C32)NN(C4CCN(CC4)C)C(=O)C5=CC(=CC=C5)OC)C)(F)F

DOS

IR

Vibrations