Geometry & MOs

Info

ID:	77080
PubChem CID:	48425781
Reduced:	O2F3N5C17H20 (1)
Stoich.:	A2B3C5D17E20 (1)
Weight, g/mol:	329.123169
ΔH_f, kcal/mol:	-189.69
Dipole, Da:	4.98
IP(EA), eV:	-9.77(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(N(N=C1)C2=NC=C(C=C2)C(F)(F)F)C

DOS

IR

Vibrations