Geometry & MOs

Info

ID:	281808
PubChem CID:	103914398
Reduced:	ON3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	197.152812
ΔH_f, kcal/mol:	-39.98
Dipole, Da:	2.32
IP(EA), eV:	-9.0(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-[1-(1-methylimidazol-2-yl)ethylamino]butan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NC=CN1C)N[C@H](C)CCO

DOS

IR

Vibrations