Geometry & MOs

Info

ID:	132489
PubChem CID:	51369641
Reduced:	N5O5H19C26 (1)
Stoich.:	A5B5C19D26 (1)
Weight, g/mol:	455.139368
ΔH_f, kcal/mol:	-29.37
Dipole, Da:	6.81
IP(EA), eV:	-9.38(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-N-methyl-2-[2-oxo-4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)quinolin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=CC2=O)C4=NC(=NO4)C5=CC=CC=N5

DOS

IR

Vibrations