Geometry & MOs

Info

ID:	310845
PubChem CID:	126588151
Reduced:	FNO2C20H24 (1)
Stoich.:	ABC2D20E24 (1)
Weight, g/mol:	407.07322
ΔH_f, kcal/mol:	-117.09
Dipole, Da:	3.18
IP(EA), eV:	-8.49(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[3-bromo-2-[(4-ethyl-2,5-dimethylphenoxy)methyl]phenyl]-N-hydroxycarbamate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2F)NC(=O)CC)CC

DOS

IR

Vibrations