Geometry & MOs

Info

ID:	205147
PubChem CID:	80060601
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	31.84
Dipole, Da:	2.58
IP(EA), eV:	-9.11(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(6-methoxypyridin-3-yl)methyl]pyrimidin-5-yl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)CC2=CN=C(C=C2)OC)CNC3CC3

DOS

IR

Vibrations