Geometry & MOs

Info

ID:	355277
PubChem CID:	127288209
Reduced:	O2N6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	342.216809
ΔH_f, kcal/mol:	0.26
Dipole, Da:	3.87
IP(EA), eV:	-8.78(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC1CCCN(C1)C2=CC(=NC=N2)N(C)CC(=O)NC3=NOC(=C3)C

DOS

IR

Vibrations