Geometry & MOs

Info

ID:	282325
PubChem CID:	103922317
Reduced:	O2N3C12H25 (1)
Stoich.:	A2B3C12D25 (1)
Weight, g/mol:	214.113984
ΔH_f, kcal/mol:	-120.17
Dipole, Da:	5.85
IP(EA), eV:	-9.11(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[1-(2-methyl-1,3-thiazol-5-yl)ethylamino]butan-1-ol

Drug info:

PubChemData

Smile

C1CN(CCC1NCCCCCCO)C(=O)N

DOS

IR

Vibrations