Geometry & MOs

Info

ID:	365677
PubChem CID:	127318398
Reduced:	N2O3C13H20 (1)
Stoich.:	A2B3C13D20 (1)
Weight, g/mol:	374.231791
ΔH_f, kcal/mol:	-89.49
Dipole, Da:	3.27
IP(EA), eV:	-9.67(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-adamantyl)-3-[2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]ethyl]urea

Drug info:

PubChemData

Smile

C1CC(OC1)CCC2=NC(=NO2)C3CCOCC3

DOS

IR

Vibrations