Geometry & MOs

Info

ID:	414790
PubChem CID:	135087753
Reduced:	SO3N4C16H26 (1)
Stoich.:	AB3C4D16E26 (1)
Weight, g/mol:	277.153875
ΔH_f, kcal/mol:	-95.06
Dipole, Da:	6.64
IP(EA), eV:	-8.9(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-(dimethylamino)-5-methylpyrimidin-2-yl]-5,6,8,8a-tetrahydro-1H-[1,3]oxazolo[3,4-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CCC(=O)NCC2=NC(=NO2)CSC

DOS

IR

Vibrations