Geometry & MOs

Info

ID:	139114
PubChem CID:	52475572
Reduced:	ClSO3N4H19C22 (1)
Stoich.:	ABC3D4E19F22 (1)
Weight, g/mol:	454.086639
ΔH_f, kcal/mol:	-49.36
Dipole, Da:	5.11
IP(EA), eV:	-8.99(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-chlorophenyl)methyl]-1,3-thiazol-2-ylidene]-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N(C(=O)N1)CC(=O)N=C2N(C=CS2)CC3=CC=CC=C3Cl)C4=CC=CC=C4

DOS

IR

Vibrations