Geometry & MOs

Info

ID:	320189
PubChem CID:	126658613
Reduced:	O8C31H44 (1)
Stoich.:	A8B31C44 (1)
Weight, g/mol:	318.161329
ΔH_f, kcal/mol:	-264.26
Dipole, Da:	7.43
IP(EA), eV:	-8.56(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[5-(1-amino-3-ethylsulfanylpropyl)-2-methyl-4-oxo-1,3-oxazolidin-3-yl]propanoate

Drug info:

PubChemData

Smile

CC(C)OCCOC1=C(C=CC(=C1)/C=C/C(=O)O[C@@H]2CC[C@]3(CO3)[C@H]([C@@H]2OC)C4(C(O4)CC=C(C)C)C)OC

DOS

IR

Vibrations