Geometry & MOs

Info

ID:	14807
PubChem CID:	421027
Reduced:	BrNOH14C17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	327.02588
ΔH_f, kcal/mol:	27.5
Dipole, Da:	6.63
IP(EA), eV:	-8.27(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-2H-pyridin-1-yl)-1-naphthalen-2-ylethanone

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C(=O)CN3C=CC=CC3Br

DOS

IR

Vibrations