Geometry & MOs

Info

ID:	280687
PubChem CID:	103850727
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	267.127072
ΔH_f, kcal/mol:	-139.49
Dipole, Da:	3.96
IP(EA), eV:	-9.84(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-fluorophenyl)-N-(4-hydroxy-1-methoxybutan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C1C2C1CCCC2

DOS

IR

Vibrations