Geometry & MOs

Info

ID:	208051
PubChem CID:	80485847
Reduced:	OF2N2C12H14 (1)
Stoich.:	AB2C2D12E14 (1)
Weight, g/mol:	205.157898
ΔH_f, kcal/mol:	-111.7
Dipole, Da:	2.71
IP(EA), eV:	-8.81(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclopropylmethyl)-6-methylpyrimidin-4-yl]propan-2-amine

Drug info:

PubChemData

Smile

C1CC(C1)CNC2=C(C=C(C(=C2)C(=O)N)F)F

DOS

IR

Vibrations