Geometry & MOs

Info

ID:	200329
PubChem CID:	79376450
Reduced:	OSN2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	284.119464
ΔH_f, kcal/mol:	-33.4
Dipole, Da:	7.63
IP(EA), eV:	-8.95(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-methyl-5-[1-(oxolan-2-yl)ethylamino]-1,2-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=NSC(=C1C(=O)C)NCC2CCCC2

DOS

IR

Vibrations