Geometry & MOs

Info

ID:	150084
PubChem CID:	53789770
Reduced:	O3N4C17H27 (2)
Stoich.:	A3B4C17D27 (2)
Weight, g/mol:	135.043262
ΔH_f, kcal/mol:	-278.49
Dipole, Da:	16.21
IP(EA), eV:	-8.5(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-imidazol-2-ylidene-2H-1,2-oxazole

Drug info:

PubChemData

Smile

C1CCC2C(C1)C3NC2NC4C5CCCCC5C(N4)NC6=C7C(C(C(C(C7O)C(=O)O)C(=O)O)O)C(N6)NC8C9CCCCC9C(N3)N8

DOS

IR

Vibrations