Geometry & MOs

Info

ID:	279352
PubChem CID:	103843340
Reduced:	FNO2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	313.06774
ΔH_f, kcal/mol:	-150.83
Dipole, Da:	4.66
IP(EA), eV:	-9.61(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[2-ethyl-2-(hydroxymethyl)butyl]benzamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)CCC1=CC=C(C=C1)F)CO

DOS

IR

Vibrations