Geometry & MOs

Info

ID:	63944
PubChem CID:	26759532
Reduced:	N2F3O5H19C21 (1)
Stoich.:	A2B3C5D19E21 (1)
Weight, g/mol:	422.108956
ΔH_f, kcal/mol:	-324.95
Dipole, Da:	3.56
IP(EA), eV:	-8.94(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CC(=O)NC2=C1C=CC(=C2)C(F)(F)F)OC(=O)CC3=CC=C(C=C3)OC

DOS

IR

Vibrations