Geometry & MOs

Info

ID:	296619
PubChem CID:	117585954
Reduced:	ON5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	250.179361
ΔH_f, kcal/mol:	-24.66
Dipole, Da:	2.43
IP(EA), eV:	-8.68(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[6-[cyclobutyl(methyl)amino]-2-methylpyrimidin-4-yl]amino]propan-1-ol

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N(C)C2CCN(C2)C)NCCO

DOS

IR

Vibrations