Geometry & MOs

Info

ID:

229444

PubChem CID:

87567677

Reduced:

N11O14C62H113 (1)

Stoich.:

A11B14C62D113 (1)

Weight, g/mol:

509.084396

ΔHf, kcal/mol:

-757.58

Dipole, Da:

7.26

IP(EA), eV:

 -9.24(0.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5R)-5-methyl-1-[(3-methylpyridin-4-yl)methyl]-3-[4-(trifluoromethylsulfanyl)phenyl]imidazolidine-2,4-dione;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

C/C=C/C[C@@H](C)[C@H]([C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)O)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)CNC)O

DOS

IR

Vibrations