Geometry & MOs

Info

ID:	420667
PubChem CID:	135114633
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	372.227374
ΔH_f, kcal/mol:	0.83
Dipole, Da:	4.85
IP(EA), eV:	-8.38(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(methoxymethyl)-6-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-yl]pyrimidin-4-yl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CN=C(C=C1)NCCCN2CCCC3=CC=CC=C32

DOS

IR

Vibrations