Geometry & MOs

Info

ID:	326434
PubChem CID:	126687542
Reduced:	INOH6C8 (2)
Stoich.:	ABCD6E8 (2)
Weight, g/mol:	412.00342
ΔH_f, kcal/mol:	25.45
Dipole, Da:	4.64
IP(EA), eV:	-9.34(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-bromo-4-hydroxy-5-(trifluoromethyl)phenyl]-(2-ethylimidazo[1,2-a]pyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CCC1=C(N2C=CC=CC2=N1)C(=O)C3=CC(=C(C(=C3)I)O)I

DOS

IR

Vibrations