Geometry & MOs

Info

ID:	267314
PubChem CID:	103581746
Reduced:	BrClNOC11H15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	329.95931
ΔH_f, kcal/mol:	-39.27
Dipole, Da:	2.64
IP(EA), eV:	-9.45(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-3-chlorophenyl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations