Geometry & MOs

Info

ID:	418212
PubChem CID:	135103878
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	358.152872
ΔH_f, kcal/mol:	-41.69
Dipole, Da:	4.37
IP(EA), eV:	-8.71(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-3-hydroxy-1-(2-oxo-1H-quinoline-4-carbonyl)-4-propylpiperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1OC)C(=O)N2C[C@H]3CN([C@@H](C2)COC3)C

DOS

IR

Vibrations