Geometry & MOs

Info

ID:	126467
PubChem CID:	50965803
Reduced:	SO2N4C19H28 (1)
Stoich.:	AB2C4D19E28 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	-33.62
Dipole, Da:	3.32
IP(EA), eV:	-8.37(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-6-morpholin-4-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1O)CN2CCC(CC2)CC3=NN=C(N3C)SC

DOS

IR

Vibrations