Geometry & MOs

Info

ID:	198564
PubChem CID:	79119614
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-45.51
Dipole, Da:	8.35
IP(EA), eV:	-8.48(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxaspiro[4.5]decan-8-yl)-N,4-dimethylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(C1CCC2(CC1)OCCO2)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations