Geometry & MOs

Info

ID:	286894
PubChem CID:	104223417
Reduced:	ON5C15H23 (1)
Stoich.:	AB5C15D23 (1)
Weight, g/mol:	305.12949
ΔH_f, kcal/mol:	21.73
Dipole, Da:	5.81
IP(EA), eV:	-8.95(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(5-chloro-2-methylphenoxy)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)OC2=NC=C(C=N2)CNC(C)(C)C

DOS

IR

Vibrations