Geometry & MOs

Info

ID:	355276
PubChem CID:	127288208
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	344.196074
ΔH_f, kcal/mol:	-82.5
Dipole, Da:	5.79
IP(EA), eV:	-8.92(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)NC2=CC(=NC=N2)N3CCCC(C3)CO

DOS

IR

Vibrations