Geometry & MOs

Info

ID:	274047
PubChem CID:	103806702
Reduced:	N2O3C8H16 (1)
Stoich.:	A2B3C8D16 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	-114.15
Dipole, Da:	3.35
IP(EA), eV:	-9.55(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-aminophenyl)ethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COCCOCC(=O)NC1CNC1

DOS

IR

Vibrations