Geometry & MOs

Info

ID:	29881
PubChem CID:	837986
Reduced:	NSO2C18H23 (1)
Stoich.:	ABC2D18E23 (1)
Weight, g/mol:	261.195346
ΔH_f, kcal/mol:	-62.72
Dipole, Da:	5.52
IP(EA), eV:	-8.77(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-di(piperidin-1-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations