Geometry & MOs

Info

ID:	28256
PubChem CID:	826568
Reduced:	OSH5C7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-13.5
Dipole, Da:	5.44
IP(EA), eV:	-8.89(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4R)-2,4,7,7-tetramethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C(=CC(=O)O)C3=C(S1)SC=C3

DOS

IR

Vibrations