Geometry & MOs

Info

ID:	286728
PubChem CID:	104222165
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-32.42
Dipole, Da:	0.66
IP(EA), eV:	-8.86(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[(cyclopropylamino)methyl]pyrimidin-2-yl]-4-methylpiperidin-4-ol

Drug info:

PubChemData

Smile

CCNCC1=CN=C(N=C1)N2CCC(CC2)(C)O

DOS

IR

Vibrations