Geometry & MOs

Info

ID:	295526
PubChem CID:	117532456
Reduced:	FN3C12H12 (1)
Stoich.:	AB3C12D12 (1)
Weight, g/mol:	217.101526
ΔH_f, kcal/mol:	19.92
Dipole, Da:	1.19
IP(EA), eV:	-9.49(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)-2-pyrimidin-4-ylethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations