Geometry & MOs

Info

ID:	297720
PubChem CID:	117626780
Reduced:	FN4O8C33H47 (1)
Stoich.:	AB4C8D33E47 (1)
Weight, g/mol:	276.999682
ΔH_f, kcal/mol:	-429.25
Dipole, Da:	10.63
IP(EA), eV:	-9.56(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;3-acetyl-2-methyl-1,3-thiazolidine-2,4-dicarboxylate

Drug info:

PubChemData

Smile

CCCC(C(=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@@H]2[C@H]3CCC(C3CN2C(=O)[C@H](C(C)(C)C)NC(=O)OC(C)C)F

DOS

IR

Vibrations