Geometry & MOs

Info

ID:	33778
PubChem CID:	7888074
Reduced:	N2O4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	406.114042
ΔH_f, kcal/mol:	-166.82
Dipole, Da:	6.59
IP(EA), eV:	-9.71(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)COC(=O)C2=CC=C(C=C2)CN3CCCC3=O

DOS

IR

Vibrations