Geometry & MOs

Info

ID:	279414
PubChem CID:	103843871
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-103.32
Dipole, Da:	3.48
IP(EA), eV:	-9.43(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)C1=CC2=CC=CC=C2O1)CO

DOS

IR

Vibrations