Geometry & MOs

Info

ID:	177894
PubChem CID:	76249715
Reduced:	Cl2N3O3H23C24 (1)
Stoich.:	A2B3C3D23E24 (1)
Weight, g/mol:	470.126006
ΔH_f, kcal/mol:	-72.24
Dipole, Da:	6.66
IP(EA), eV:	-9.22(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-amino-2-oxoethyl)phenyl]-6-morpholin-4-ylsulfonyl-2-oxo-4aH-quinoline-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C=CC2=CC=C(C=C2)C(=O)NC3CC3)C(=O)NC4=CC(=CC(=C4)Cl)Cl

DOS

IR

Vibrations