Geometry & MOs

Info

ID:	24339
PubChem CID:	609425
Reduced:	NSO2H15C18 (1)
Stoich.:	ABC2D15E18 (1)
Weight, g/mol:	309.08235
ΔH_f, kcal/mol:	11.16
Dipole, Da:	2.03
IP(EA), eV:	-9.14(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-2-methoxy-1-(2-phenylquinolin-4-yl)ethanethione

Drug info:

PubChemData

Smile

COC(C(=S)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3)O

DOS

IR

Vibrations