Geometry & MOs

Info

ID:	209484
PubChem CID:	80678370
Reduced:	FNOBr2H10C11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	332.05243
ΔH_f, kcal/mol:	-62.48
Dipole, Da:	4.57
IP(EA), eV:	-9.92(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(bromomethyl)piperidin-1-yl]-quinolin-5-ylmethanone

Drug info:

PubChemData

Smile

C1CN(CC1Br)C(=O)C2=CC(=C(C=C2)Br)F

DOS

IR

Vibrations