Geometry & MOs

Info

ID:	314619
PubChem CID:	126622463
Reduced:	ClNSO3H14C21 (1)
Stoich.:	ABCD3E14F21 (1)
Weight, g/mol:	510.215472
ΔH_f, kcal/mol:	-17.51
Dipole, Da:	3.42
IP(EA), eV:	-9.21(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-5-oxo-5-(2-oxo-4-propan-2-yl-1,3-oxazolidin-3-yl)-1-(4-phenylphenyl)pentan-2-yl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(C2=CC=C(C=C2)OC3=NC4=C(S3)C=C(C=C4)Cl)O

DOS

IR

Vibrations