Geometry & MOs

Info

ID:	279399
PubChem CID:	103843755
Reduced:	NO3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-142.09
Dipole, Da:	3.61
IP(EA), eV:	-9.19(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dimethylphenoxy)-N-[2-ethyl-2-(hydroxymethyl)butyl]acetamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)CCOC1=CC=CC=C1C)CO

DOS

IR

Vibrations