Geometry & MOs

Info

ID:	354853
PubChem CID:	127287613
Reduced:	NOC3H5 (4)
Stoich.:	ABC3D5 (4)
Weight, g/mol:	282.169191
ΔH_f, kcal/mol:	-125.91
Dipole, Da:	4.81
IP(EA), eV:	-9.6(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]-3-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NC(=O)NCC2COCCO2

DOS

IR

Vibrations