Geometry & MOs

Info

ID:	275262
PubChem CID:	103814889
Reduced:	OSN3C14H23 (1)
Stoich.:	ABC3D14E23 (1)
Weight, g/mol:	296.167083
ΔH_f, kcal/mol:	-42.66
Dipole, Da:	1.76
IP(EA), eV:	-9.3(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-2-methyl-2-piperazin-1-ylpropanamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)C2CCC(CC2)CN

DOS

IR

Vibrations