Geometry & MOs

Info

ID:	417308
PubChem CID:	135091991
Reduced:	ON4C24H28 (1)
Stoich.:	AB4C24D28 (1)
Weight, g/mol:	251.118238
ΔH_f, kcal/mol:	32.94
Dipole, Da:	3.03
IP(EA), eV:	-8.91(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-4-methoxy-N-(1-pyrazol-1-ylpropan-2-yl)pyrimidin-2-amine

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5)CO

DOS

IR

Vibrations