Geometry & MOs

Info

ID:	395070
PubChem CID:	135024574
Reduced:	ClLiNOC7H11 (1)
Stoich.:	ABCDE7F11 (1)
Weight, g/mol:	434.220557
ΔH_f, kcal/mol:	-81.92
Dipole, Da:	6.21
IP(EA), eV:	-7.26(1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1,4-bis(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1,4-diphenylbut-2-ene-1,4-diol

Drug info:

PubChemData

Smile

[Li+].C[C-](C1=NC(CO1)(C)C)Cl

DOS

IR

Vibrations