Geometry & MOs

Info

ID:	380695
PubChem CID:	134971222
Reduced:	NO8C38H41 (1)
Stoich.:	AB8C38D41 (1)
Weight, g/mol:	450.267114
ΔH_f, kcal/mol:	-270.87
Dipole, Da:	8.98
IP(EA), eV:	-9.53(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]-2-methyl-3-phenylprop-2-en-1-ol

Drug info:

PubChemData

Smile

CCCCCCC(=O)CC/C=C/C[C@@H]1[C@@H]([C@](C(=O)O1)(COC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations