Geometry & MOs

Info

ID:	224701
PubChem CID:	85346968
Reduced:	SN3O3H21C25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	445.267977
ΔH_f, kcal/mol:	-11.65
Dipole, Da:	8.71
IP(EA), eV:	-8.45(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl]propanoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)C=CC(=O)NC4=CC=CC=C4N

DOS

IR

Vibrations