Geometry & MOs

Info

ID:	264740
PubChem CID:	103487024
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	308.119464
ΔH_f, kcal/mol:	-58.62
Dipole, Da:	4.58
IP(EA), eV:	-8.72(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-[ethyl(furan-2-ylmethyl)amino]-1,3-thiazol-4-yl]propanoate

Drug info:

PubChemData

Smile

CCN(CC(C)C#N)C1=NC(=CS1)CCC(=O)OCC

DOS

IR

Vibrations