Geometry & MOs

Info

ID:	121707
PubChem CID:	50778428
Reduced:	O2N5C19H19 (1)
Stoich.:	A2B5C19D19 (1)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	27.93
Dipole, Da:	6.31
IP(EA), eV:	-8.81(-0.68)
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-phenylethyl)urea

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=NOC(=N3)C4CCC4

DOS

IR

Vibrations