Geometry & MOs

Info

ID:	234330
PubChem CID:	92298195
Reduced:	S2N3O5H23C27 (1)
Stoich.:	A2B3C5D23E27 (1)
Weight, g/mol:	542.95038
ΔH_f, kcal/mol:	-40.55
Dipole, Da:	2.65
IP(EA), eV:	-8.47(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-1-(4-bromophenyl)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)[C@H]2C(=C(C(=O)N2C3=NN=C(S3)C)O)C(=O)C4=CC=CS4)OCC5=CC=CC=C5

DOS

IR

Vibrations