Geometry & MOs

Info

ID:	133163
PubChem CID:	51486113
Reduced:	ClSN3O4C22H22 (1)
Stoich.:	ABC3D4E22F22 (1)
Weight, g/mol:	420.168522
ΔH_f, kcal/mol:	-141.38
Dipole, Da:	4.99
IP(EA), eV:	-9.0(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl] 2-(4-methoxyphenyl)quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=C(C=C2)Cl)CSC3=CC=C(C=C3)NC(=O)C

DOS

IR

Vibrations