Geometry & MOs

Info

ID:	279338
PubChem CID:	103843162
Reduced:	SN2O3C10H22 (1)
Stoich.:	AB2C3D10E22 (1)
Weight, g/mol:	297.174022
ΔH_f, kcal/mol:	-141.56
Dipole, Da:	5.25
IP(EA), eV:	-8.92(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-2-(4-fluorophenoxy)propanamide

Drug info:

PubChemData

Smile

CC(COC)NC[C@H]1CCCN1S(=O)(=O)C

DOS

IR

Vibrations