Geometry & MOs

Info

ID:	299344
PubChem CID:	117682705
Reduced:	N5C15H19 (1)
Stoich.:	A5B15C19 (1)
Weight, g/mol:	242.127994
ΔH_f, kcal/mol:	47.64
Dipole, Da:	2.09
IP(EA), eV:	-9.2(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-(azetidin-1-yl)-2-methylpyrimidin-4-yl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)C2CCCCC2)C3=CN=C(N=C3)N

DOS

IR

Vibrations