Geometry & MOs

Info

ID:	395700
PubChem CID:	135026281
Reduced:	O2C5H8 (4)
Stoich.:	A2B5C8 (4)
Weight, g/mol:	513.238
ΔH_f, kcal/mol:	-337.35
Dipole, Da:	3.27
IP(EA), eV:	-9.52(0.08)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

ethyl (E)-5-[[(S)-tert-butylsulfinyl]amino]pent-2-enoate;rutherfordium

Drug info:

PubChemData

Smile

CC(=C)[C@@H]1C[C@H](C2(CC([C@]1(C2=O)C(=O)OC)C(C)(C)O)OCOC)OCOC

DOS

IR

Vibrations