Geometry & MOs

Info

ID:	9071
PubChem CID:	85821
Reduced:	NC10H14 (2)
Stoich.:	AB10C14 (2)
Weight, g/mol:	296.225249
ΔH_f, kcal/mol:	11.53
Dipole, Da:	2.84
IP(EA), eV:	-7.71(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-octan-2-yl-1-N-phenylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

CCCCCCC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2

DOS

IR

Vibrations