Geometry & MOs

Info

ID:	279346
PubChem CID:	103843237
Reduced:	N2O4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	343.07831
ΔH_f, kcal/mol:	-163.24
Dipole, Da:	1.66
IP(EA), eV:	-9.55(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)CN(C)C(=O)C1=CC=CO1)CO

DOS

IR

Vibrations