Geometry & MOs

Info

ID:	206952
PubChem CID:	80324730
Reduced:	ClSN2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	248.075012
ΔH_f, kcal/mol:	106.16
Dipole, Da:	4.95
IP(EA), eV:	-8.98(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethoxy)-N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2CC3=NC=CS3)Cl

DOS

IR

Vibrations