Geometry & MOs

Info

ID:	267234
PubChem CID:	103581471
Reduced:	BrClNOC11H15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	332.06549
ΔH_f, kcal/mol:	-30.96
Dipole, Da:	4.13
IP(EA), eV:	-9.24(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-3-chlorophenyl)methyl]-N',N',2,2-tetramethylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC(COC)NCC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations