Geometry & MOs

Info

ID:	424109
PubChem CID:	135121345
Reduced:	NCl2O3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	305.081871
ΔH_f, kcal/mol:	-133.33
Dipole, Da:	4.63
IP(EA), eV:	-8.82(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-cyclopropyl-2-ethyl-8-methyl-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CN1CCC2=C(C(=C(C=C2C(C1)C3=CC=C(C=C3)O)O)O)Cl.Cl

DOS

IR

Vibrations