Geometry & MOs

Info

ID:	267245
PubChem CID:	103581506
Reduced:	BrClN2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	352.03419
ΔH_f, kcal/mol:	4.46
Dipole, Da:	4.47
IP(EA), eV:	-8.76(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(4-bromo-3-chlorophenyl)methylamino]methyl]-N,N-dimethylaniline

Drug info:

PubChemData

Smile

CCN1CCC(CC1)NCC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations