Geometry & MOs

Info

ID:	279400
PubChem CID:	103843759
Reduced:	NO3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	307.150761
ΔH_f, kcal/mol:	-145.54
Dipole, Da:	5.36
IP(EA), eV:	-9.04(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)COC1=CC=CC(=C1C)C)CO

DOS

IR

Vibrations