Geometry & MOs

Info

ID:	5394
PubChem CID:	13101
Reduced:	NC9H12 (2)
Stoich.:	AB9C12 (2)
Weight, g/mol:	268.193949
ΔH_f, kcal/mol:	18.96
Dipole, Da:	3.84
IP(EA), eV:	-7.91(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(4-methylpentan-2-yl)-1-N-phenylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations