Geometry & MOs

Info

ID:	272722
PubChem CID:	103753138
Reduced:	BrNOSC12H18 (1)
Stoich.:	ABCDE12F18 (1)
Weight, g/mol:	240.129634
ΔH_f, kcal/mol:	-36.51
Dipole, Da:	2.72
IP(EA), eV:	-9.18(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-methyl-1,3-thiazol-5-yl)methylamino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

C1CC(CCC1CO)NCC2=CC(=CS2)Br

DOS

IR

Vibrations