Geometry & MOs

Info

ID:	37549
PubChem CID:	8022125
Reduced:	BrNO6C17H20 (1)
Stoich.:	ABC6D17E20 (1)
Weight, g/mol:	377.02627
ΔH_f, kcal/mol:	-248.11
Dipole, Da:	5.0
IP(EA), eV:	-9.37(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-ethylanilino)-2-oxoethyl] 5-bromo-2-hydroxybenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations