Geometry & MOs

Info

ID:

185805

PubChem CID:

77350613

Reduced:

ClFO3N4H26C30 (1)

Stoich.:

ABC3D4E26F30 (1)

Weight, g/mol:

638.502259

ΔHf, kcal/mol:

-45.87

Dipole, Da:

4.1

IP(EA), eV:

 -8.55(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one;2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2F)C(=O)CC3=CC=C(C4=CC=CC=C34)C=NNC(=O)C5=CC(=C(C=C5)O)Cl

DOS

IR

Vibrations