Geometry & MOs

Info

ID:	282002
PubChem CID:	103914652
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	214.204513
ΔH_f, kcal/mol:	-84.57
Dipole, Da:	2.33
IP(EA), eV:	-8.4(2.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[[1-(2-methylpropyl)piperidin-4-yl]amino]propan-2-ol

Drug info:

PubChemData

Smile

CCC(CC)N1CCC(CC1)NC[C@H](C)O

DOS

IR

Vibrations