Geometry & MOs

Info

ID:	264739
PubChem CID:	103487000
Reduced:	SO2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-83.96
Dipole, Da:	4.51
IP(EA), eV:	-8.68(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=CSC(=N1)NC(C)CN2CCCC2

DOS

IR

Vibrations