Geometry & MOs

Info

ID:	245517
PubChem CID:	99453653
Reduced:	ClSN3O3H20C25 (1)
Stoich.:	ABC3D3E20F25 (1)
Weight, g/mol:	411.098584
ΔH_f, kcal/mol:	4.82
Dipole, Da:	4.5
IP(EA), eV:	-9.06(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-chlorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C2=NOC(=C2)C3=CC=CC=C3Cl)C(=O)N4CCC5=C(C4)C=CS5

DOS

IR

Vibrations