Geometry & MOs

Info

ID:	327737
PubChem CID:	126690928
Reduced:	BrN2C7H7 (1)
Stoich.:	AB2C7D7 (1)
Weight, g/mol:	301.157898
ΔH_f, kcal/mol:	104.16
Dipole, Da:	1.07
IP(EA), eV:	-8.57(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-2-(1-methylimidazol-2-yl)-4H-quinoline

Drug info:

PubChemData

Smile

C=C/1/C=C\C=N/N/C=C1/Br

DOS

IR

Vibrations