Geometry & MOs

Info

ID:	32677
PubChem CID:	7847093
Reduced:	NO4H23C26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	382.225643
ΔH_f, kcal/mol:	-102.62
Dipole, Da:	7.55
IP(EA), eV:	-9.16(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 2-ethyl-3-methylquinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC(=O)OC4=C3C=C5CCCC5=C4

DOS

IR

Vibrations