Geometry & MOs

Info

ID:	27004
PubChem CID:	811127
Reduced:	SN2O3C17H26 (1)
Stoich.:	AB2C3D17E26 (1)
Weight, g/mol:	310.135114
ΔH_f, kcal/mol:	-125.38
Dipole, Da:	1.53
IP(EA), eV:	-9.53(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[acetyl(cyclohexyl)amino]methyl]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CCCC(=O)N(CC1=NC(=CS1)C(=O)OCC)C2CCCCC2

DOS

IR

Vibrations