Geometry & MOs

Info

ID:	397354
PubChem CID:	135030096
Reduced:	SN2O3C20H20 (1)
Stoich.:	AB2C3D20E20 (1)
Weight, g/mol:	381.164135
ΔH_f, kcal/mol:	-72.02
Dipole, Da:	4.52
IP(EA), eV:	-8.4(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (5R)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2,2-dioxooxathiazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C3=C2C(C(=O)N(C3)S(=O)(=O)C)C4=CC=CC=C4)C

DOS

IR

Vibrations