Geometry & MOs

Info

ID:	25280
PubChem CID:	622170
Reduced:	SO2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	321.136493
ΔH_f, kcal/mol:	-14.81
Dipole, Da:	4.94
IP(EA), eV:	-8.94(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxy-6-(4-nitrophenyl)naphthalene

Drug info:

PubChemData

Smile

CCN1C(=NN=C1S)C2=CC(=CC(=C2)OC)OC

DOS

IR

Vibrations