Geometry & MOs

Info

ID:	278846
PubChem CID:	103839016
Reduced:	ClFON2C13H20 (1)
Stoich.:	ABCD2E13F20 (1)
Weight, g/mol:	314.177647
ΔH_f, kcal/mol:	-89.78
Dipole, Da:	2.72
IP(EA), eV:	-8.61(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]methyl]-1,3-thiazol-2-yl]-N-ethylacetamide

Drug info:

PubChemData

Smile

CC(CNCC1=C(C=C(C=C1)F)Cl)(CN(C)C)O

DOS

IR

Vibrations