Geometry & MOs

Info

ID:	267268
PubChem CID:	103581581
Reduced:	BrClNOC13H19 (1)
Stoich.:	ABCDE13F19 (1)
Weight, g/mol:	369.01312
ΔH_f, kcal/mol:	-41.46
Dipole, Da:	4.67
IP(EA), eV:	-9.26(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-3-chlorophenyl)-N-[(2,4-dimethoxyphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CC(C)COCCNCC1=CC(=C(C=C1)Br)Cl

DOS

IR

Vibrations