Geometry & MOs

Info

ID:	341789
PubChem CID:	127264482
Reduced:	NNaO3H4C6 (1)
Stoich.:	ABC3D4E6 (1)
Weight, g/mol:	454.152872
ΔH_f, kcal/mol:	-143.51
Dipole, Da:	7.45
IP(EA), eV:	-9.42(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(2-oxo-1H-quinolin-4-yl)propanoic acid

Drug info:

PubChemData

Smile

C1=CC(=O)NC=C1C(=O)[O-].[Na+]

DOS

IR

Vibrations