Geometry & MOs

Info

ID:	150771
PubChem CID:	53790467
Reduced:	Cl2N2O3C23H24 (1)
Stoich.:	A2B2C3D23E24 (1)
Weight, g/mol:	446.116398
ΔH_f, kcal/mol:	-72.74
Dipole, Da:	3.87
IP(EA), eV:	-9.11(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[(2R,6S)-6-(2,4-dichlorophenoxy)oxan-2-yl]methoxy]-2-phenylethyl]imidazole

Drug info:

PubChemData

Smile

C1C[C@@H](O[C@@H](C1)OC2=C(C=C(C=C2)Cl)Cl)COC(CN3C=CN=C3)C4=CC=CC=C4

DOS

IR

Vibrations