Geometry & MOs

Info

ID:	187410
PubChem CID:	77570790
Reduced:	BrCl3N3O5C24H31 (1)
Stoich.:	AB3C3D5E24F31 (1)
Weight, g/mol:	345.233535
ΔH_f, kcal/mol:	-237.24
Dipole, Da:	4.09
IP(EA), eV:	-8.59(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-[tert-butyl(dimethyl)silyl]oxy-2-(methoxymethyl)pyrrolidin-1-ium-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)N1C(C(=CC(=C1NC(=O)O)OCC(CC2=C(C=C(C=C2)Cl)Cl)NC(=O)OC(C)(C)C)Br)Cl

DOS

IR

Vibrations