Geometry & MOs

Info

ID:	292516
PubChem CID:	115144607
Reduced:	FNO4C12H14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	325.01023
ΔH_f, kcal/mol:	-202.16
Dipole, Da:	5.25
IP(EA), eV:	-9.96(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-bromonaphthalen-2-yl)-2-pyridin-2-ylethanone

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CNCC(CC(=O)O)C(=O)O

DOS

IR

Vibrations