Geometry & MOs

Info

ID:	277687
PubChem CID:	103830366
Reduced:	BrNO4C14H16 (1)
Stoich.:	ABC4D14E16 (1)
Weight, g/mol:	285.03644
ΔH_f, kcal/mol:	-153.9
Dipole, Da:	4.75
IP(EA), eV:	-9.44(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-hydroxy-N-(3-methylbutan-2-yl)benzamide

Drug info:

PubChemData

Smile

COC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Br)O

DOS

IR

Vibrations