Geometry & MOs

Info

ID:	288401
PubChem CID:	104316302
Reduced:	BrN5C15H18 (1)
Stoich.:	AB5C15D18 (1)
Weight, g/mol:	250.96942
ΔH_f, kcal/mol:	66.29
Dipole, Da:	2.19
IP(EA), eV:	-9.97(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromopyridin-2-yl)-1H-imidazole-5-carbaldehyde

Drug info:

PubChemData

Smile

C1CCCC(CC1)C2=NC(=NC(=N2)C3=NC=C(C=C3)Br)N

DOS

IR

Vibrations