Geometry & MOs

Info

ID:	349705
PubChem CID:	127275857
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	314.11227
ΔH_f, kcal/mol:	-126.89
Dipole, Da:	5.77
IP(EA), eV:	-8.85(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCCN(C2=C(C=C1)OC)C(=O)C3CCCN(C3)C(=O)N4CCCC4

DOS

IR

Vibrations