Geometry & MOs

Info

ID:	277003
PubChem CID:	103826207
Reduced:	FN3C12H18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	226.122989
ΔH_f, kcal/mol:	-30.55
Dipole, Da:	2.88
IP(EA), eV:	-8.92(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-fluoropyrimidin-2-yl)amino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC1(CCCCC1)CNC2=NC=C(C=N2)F

DOS

IR

Vibrations