Geometry & MOs

Info

ID:	264738
PubChem CID:	103486878
Reduced:	SO2N3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-64.97
Dipole, Da:	5.54
IP(EA), eV:	-8.84(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-(1-pyrrolidin-1-ylpropan-2-ylamino)-1,3-thiazol-4-yl]propanoate

Drug info:

PubChemData

Smile

CN1CCC(C1)NC2=NC(=CS2)CCC(=O)O

DOS

IR

Vibrations