Geometry & MOs

Info

ID:	263406
PubChem CID:	103364895
Reduced:	SN3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	257.119798
ΔH_f, kcal/mol:	-5.43
Dipole, Da:	4.81
IP(EA), eV:	-8.4(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-amino-4-methyl-1,2-thiazol-5-yl)piperidin-4-yl]oxyethanol

Drug info:

PubChemData

Smile

CCCCCCCCNC1=C(C(=NS1)N)C

DOS

IR

Vibrations