Geometry & MOs

Info

ID:	268900
PubChem CID:	103602039
Reduced:	NO2F3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	287.01571
ΔH_f, kcal/mol:	-199.81
Dipole, Da:	4.69
IP(EA), eV:	-9.28(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-hydroxy-N-(1-hydroxybutan-2-yl)benzamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C(F)F

DOS

IR

Vibrations