Geometry & MOs

Info

ID:	279410
PubChem CID:	103843861
Reduced:	ClNF2O2C14H18 (1)
Stoich.:	ABC2D2E14F18 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-188.05
Dipole, Da:	4.87
IP(EA), eV:	-9.99(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-2-(hydroxymethyl)butyl]-3,5-dimethylbenzamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)C1=CC(=C(C=C1Cl)F)F)CO

DOS

IR

Vibrations