Geometry & MOs

Info

ID:	228548
PubChem CID:	87565263
Reduced:	N2O8C19H34 (1)
Stoich.:	A2B8C19D34 (1)
Weight, g/mol:	526.05075
ΔH_f, kcal/mol:	-398.92
Dipole, Da:	7.31
IP(EA), eV:	-9.97(0.11)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(5R)-5-methyl-2,4-dioxo-1-(pyridin-4-ylmethyl)-3-[4-(trifluoromethylsulfonyl)phenyl]imidazolidin-1-ium-1-yl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)OCC(COC(=O)CCC(=O)O)OC(=O)[C@H](C(C)CC)N)N

DOS

IR

Vibrations