Geometry & MOs

Info

ID:	342764
PubChem CID:	127265927
Reduced:	SF2N2O3C13H24 (1)
Stoich.:	AB2C2D3E13F24 (1)
Weight, g/mol:	338.0266
ΔH_f, kcal/mol:	-271.62
Dipole, Da:	1.98
IP(EA), eV:	-9.97(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-3-hydroxy-N-(2-methoxyethyl)-N-methylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)CN(CC)S(=O)(=O)CC1CCCC(C1)(F)F

DOS

IR

Vibrations