Geometry & MOs

Info

ID:	286835
PubChem CID:	104223136
Reduced:	OCl2N3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	325.074868
ΔH_f, kcal/mol:	24.52
Dipole, Da:	5.69
IP(EA), eV:	-9.36(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(3,4-dichlorophenoxy)pyrimidin-5-yl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1OC2=NC=C(C=N2)CN)Cl)Cl

DOS

IR

Vibrations