Geometry & MOs

Info

ID:	326436
PubChem CID:	126687546
Reduced:	ClNOC9H10 (1)
Stoich.:	ABCD9E10 (1)
Weight, g/mol:	453.93507
ΔH_f, kcal/mol:	43.99
Dipole, Da:	3.09
IP(EA), eV:	-9.12(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-6-methoxyimidazo[1,2-a]pyridin-3-yl)methanone

Drug info:

PubChemData

Smile

C=C/C=C(\C1=C(CCC1)N=O)/Cl

DOS

IR

Vibrations