Geometry & MOs

Info

ID:	371453
PubChem CID:	127346452
Reduced:	O2N5C21H31 (1)
Stoich.:	A2B5C21D31 (1)
Weight, g/mol:	254.108899
ΔH_f, kcal/mol:	-65.68
Dipole, Da:	5.63
IP(EA), eV:	-8.94(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)N2CCCN(CC2)C(=O)C3=NC(=NC=C3)N4CCCC4

DOS

IR

Vibrations