Geometry & MOs

Info

ID:	282434
PubChem CID:	103926782
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	286.131742
ΔH_f, kcal/mol:	-169.39
Dipole, Da:	5.66
IP(EA), eV:	-10.27(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3,3-dimethyl-2-(quinoline-5-carbonylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)O)NC(=O)C1=CC=C(C=C1)C(=O)N

DOS

IR

Vibrations