Geometry & MOs

Info

ID:	147718
PubChem CID:	53787375
Reduced:	BrNO3C12H14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	209.084064
ΔH_f, kcal/mol:	-35.06
Dipole, Da:	3.51
IP(EA), eV:	-10.61(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzo[h]quinolin-4-ylmethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)CCCCCBr)[N+](=O)[O-]

DOS

IR

Vibrations