Geometry & MOs

Info

ID:	299354
PubChem CID:	117682721
Reduced:	FNC9H18 (1)
Stoich.:	ABC9D18 (1)
Weight, g/mol:	242.127994
ΔH_f, kcal/mol:	-81.24
Dipole, Da:	0.85
IP(EA), eV:	-8.63(2.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-(azetidin-3-yl)-2-methylpyrimidin-4-yl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H]1F)C(C)(C)C

DOS

IR

Vibrations