Geometry & MOs

Info

ID:	149944
PubChem CID:	53789626
Reduced:	OC6H13 (2)
Stoich.:	AB6C13 (2)
Weight, g/mol:	353.108565
ΔH_f, kcal/mol:	-130.72
Dipole, Da:	1.19
IP(EA), eV:	-9.43(1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 6-methoxy-3-phenyl-2-sulfanylidene-1H-quinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCCCC(CC)COCCOCC

DOS

IR

Vibrations