Geometry & MOs

Info

ID:	245052
PubChem CID:	99432256
Reduced:	N2O3C24H24 (1)
Stoich.:	A2B3C24D24 (1)
Weight, g/mol:	417.205242
ΔH_f, kcal/mol:	-57.03
Dipole, Da:	4.29
IP(EA), eV:	-8.29(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2,4,6-trimethylanilino)ethyl] 2-pyrrolidin-1-ylquinoline-3-carboxylate

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC3=CC=CC=C3C=C2C(=O)OCCCC(=O)C4=CC=CC=C4

DOS

IR

Vibrations