Geometry & MOs

Info

ID:	265104
PubChem CID:	103510557
Reduced:	SN3O3C11H15 (1)
Stoich.:	AB3C3D11E15 (1)
Weight, g/mol:	283.099063
ΔH_f, kcal/mol:	-96.26
Dipole, Da:	3.75
IP(EA), eV:	-9.7(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylimidazole-4-carbonyl)-2-propyl-1,3-thiazolidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1N(C(CS1)C(=O)O)C(=O)C2=CN=CN2C

DOS

IR

Vibrations