Geometry & MOs

Info

ID:	81340
PubChem CID:	49854620
Reduced:	N2O3H22C26 (1)
Stoich.:	A2B3C22D26 (1)
Weight, g/mol:	548.139942
ΔH_f, kcal/mol:	8.81
Dipole, Da:	4.83
IP(EA), eV:	-8.71(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(1,1-dioxo-1,4-thiazinan-4-yl)-N-hydroxy-3-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]propanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)OCC3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations