Geometry & MOs

Info

ID:	295527
PubChem CID:	117532478
Reduced:	FN3C12H12 (1)
Stoich.:	AB3C12D12 (1)
Weight, g/mol:	241.157898
ΔH_f, kcal/mol:	16.16
Dipole, Da:	2.26
IP(EA), eV:	-9.63(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyrimidin-4-yl-2-(2,4,6-trimethylphenyl)ethanamine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C(CN)C2=NC=NC=C2

DOS

IR

Vibrations