Geometry & MOs

Info

ID:	286867
PubChem CID:	104223303
Reduced:	OF2N3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	293.133969
ΔH_f, kcal/mol:	-31.43
Dipole, Da:	4.59
IP(EA), eV:	-9.48(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(2,5-difluorophenoxy)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

C1CC1NCC2=CN=C(N=C2)OC3=C(C=CC(=C3)F)F

DOS

IR

Vibrations