Geometry & MOs

Info

ID:	355274
PubChem CID:	127288206
Reduced:	ON5C17H27 (1)
Stoich.:	AB5C17D27 (1)
Weight, g/mol:	303.20591
ΔH_f, kcal/mol:	-40.99
Dipole, Da:	5.06
IP(EA), eV:	-8.8(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(6-piperidin-1-ylpyrimidin-4-yl)amino]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1CCCN(C1)C2=NC=NC(=C2)NC3CCN(CC3)C(=O)C

DOS

IR

Vibrations