Geometry & MOs

Info

ID:	121705
PubChem CID:	50778269
Reduced:	SO4N5H15C16 (1)
Stoich.:	AB4C5D15E16 (1)
Weight, g/mol:	376.189926
ΔH_f, kcal/mol:	-50.76
Dipole, Da:	5.99
IP(EA), eV:	-9.19(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)phenyl]-3-(2,4,6-trimethylphenyl)urea

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)S(=O)(=O)N

DOS

IR

Vibrations