Geometry & MOs

Info

ID:	281803
PubChem CID:	103914388
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	197.152812
ΔH_f, kcal/mol:	-48.04
Dipole, Da:	2.94
IP(EA), eV:	-9.04(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[1-(1-methylimidazol-2-yl)propylamino]propan-1-ol

Drug info:

PubChemData

Smile

CC1CCC2=CC=CC=C2C1N[C@@H](C)CO

DOS

IR

Vibrations