Geometry & MOs

Info

ID:	55561
PubChem CID:	17395551
Reduced:	OS2N4C11H18 (1)
Stoich.:	AB2C4D11E18 (1)
Weight, g/mol:	244.070405
ΔH_f, kcal/mol:	-5.1
Dipole, Da:	5.49
IP(EA), eV:	-8.52(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)SC(C)C(=O)N2CCCC2

DOS

IR

Vibrations