Geometry & MOs

Info

ID:	374587
PubChem CID:	131331843
Reduced:	BrClFIH4C7 (1)
Stoich.:	ABCDE4F7 (1)
Weight, g/mol:	225.129969
ΔH_f, kcal/mol:	-16.69
Dipole, Da:	1.91
IP(EA), eV:	-9.99(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-methyl-2-(1-methylpiperidin-3-yl)-1,3-thiazol-4-yl]methanamine

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1F)CCl)I)Br

DOS

IR

Vibrations