Geometry & MOs

Info

ID:	292529
PubChem CID:	115354201
Reduced:	BrON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	341.01637
ΔH_f, kcal/mol:	-8.6
Dipole, Da:	3.21
IP(EA), eV:	-9.22(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-aminopyridin-3-yl)-6-bromonaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN)C(=O)C2=CC3=C(C=C2)C=C(C=C3)Br

DOS

IR

Vibrations