Geometry & MOs

Info

ID:	231955
PubChem CID:	87574996
Reduced:	BrClFON4H9C17 (1)
Stoich.:	ABCDE4F9G17 (1)
Weight, g/mol:	256.287849
ΔH_f, kcal/mol:	86.06
Dipole, Da:	7.98
IP(EA), eV:	-9.18(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,2-N-dihexyl-2-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=N/C(=C/3\C(=NC(=N3)C4=C(C=CC=C4Cl)F)Br)/ON2

DOS

IR

Vibrations