Geometry & MOs

Info

ID:	378585
PubChem CID:	134224676
Reduced:	OC9H17 (2)
Stoich.:	AB9C17 (2)
Weight, g/mol:	355.0667
ΔH_f, kcal/mol:	-143.68
Dipole, Da:	2.71
IP(EA), eV:	-9.43(2.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-nitronaphthalen-2-yl)dibenzothiophene

Drug info:

PubChemData

Smile

CCC1CCC(C(C1)C2CC(CCC2OC)OC)CC

DOS

IR

Vibrations