Geometry & MOs

Info

ID:	320730
PubChem CID:	126663129
Reduced:	N6C21H22 (1)
Stoich.:	A6B21C22 (1)
Weight, g/mol:	179.142248
ΔH_f, kcal/mol:	148.8
Dipole, Da:	9.04
IP(EA), eV:	-8.05(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[amino(butyl)amino]aniline

Drug info:

PubChemData

Smile

CC(C)(C)C1=C/C(=C\2/N=C3C=CC(=CC3=N2)C4=CC(=C(C=C4)N=C)N)/NN1

DOS

IR

Vibrations