Geometry & MOs

Info

ID:	126007
PubChem CID:	50948169
Reduced:	ON6C21H36 (1)
Stoich.:	AB6C21D36 (1)
Weight, g/mol:	333.147727
ΔH_f, kcal/mol:	-24.86
Dipole, Da:	1.49
IP(EA), eV:	-8.32(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(furan-2-yl)-3-[(4-phenyl-5-propylimidazol-1-yl)methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)C2=CN(N=N2)CC3CCCNC3)N4CCCCC4

DOS

IR

Vibrations