Geometry & MOs

Info

ID:	296623
PubChem CID:	117586043
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	266.210661
ΔH_f, kcal/mol:	-33.66
Dipole, Da:	4.65
IP(EA), eV:	-8.88(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[methyl-[2-methyl-6-[methyl(2-methylpropyl)amino]pyrimidin-4-yl]amino]propan-1-ol

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)NCC2CCC2)NCCCO

DOS

IR

Vibrations