Geometry & MOs

Info

ID:	178340
PubChem CID:	76312584
Reduced:	O2Cl3N3H10C15 (1)
Stoich.:	A2B3C3D10E15 (1)
Weight, g/mol:	378.02554
ΔH_f, kcal/mol:	-15.26
Dipole, Da:	1.51
IP(EA), eV:	-9.47(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3R)-3-(3-bromophenyl)oxiran-2-yl]-(4-phenylphenyl)methanone

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)C(=O)N(C(=N2)COC3=C(C=C(C=C3)Cl)Cl)N

DOS

IR

Vibrations