Geometry & MOs

Info

ID:	178695
PubChem CID:	76369317
Reduced:	O4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-229.34
Dipole, Da:	3.44
IP(EA), eV:	-10.49(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-3-phenyl-1,2-oxazolidin-5-yl)-5-pent-1-ynyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCCCCCCCCCCC1C(C2C(O1)CC(=O)O2)O

DOS

IR

Vibrations