Geometry & MOs

Info

ID:	332672
PubChem CID:	127250958
Reduced:	O3N5C19H25 (1)
Stoich.:	A3B5C19D25 (1)
Weight, g/mol:	301.153875
ΔH_f, kcal/mol:	-42.44
Dipole, Da:	4.41
IP(EA), eV:	-9.19(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropylmethyl)-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pyrimidin-4-yl]morpholine

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)C2=CN=CN=C2C3CN(CCO3)C(=O)C4CCCCC4

DOS

IR

Vibrations