Geometry & MOs

Info

ID:	234269
PubChem CID:	92298068
Reduced:	ClON5H24C33 (1)
Stoich.:	ABC5D24E33 (1)
Weight, g/mol:	523.9558
ΔH_f, kcal/mol:	157.43
Dipole, Da:	8.4
IP(EA), eV:	-8.38(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-3-[(5S)-5-(4-bromophenyl)-1,2-oxazolidin-3-ylidene]-4-phenylquinolin-2-one

Drug info:

PubChemData

Smile

C1[C@@H](NNC1=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)C5=CN(N=C5C6=CC=CC=C6)C7=CC=CC=C7

DOS

IR

Vibrations