Geometry & MOs

Info

ID:	279424
PubChem CID:	103843892
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-109.1
Dipole, Da:	4.18
IP(EA), eV:	-9.36(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-3-phenoxypropanamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)C1=CC=CC(=C1C)C)CO

DOS

IR

Vibrations