Geometry & MOs

Info

ID:

134486

PubChem CID:

51704947

Reduced:

N4O5H24C25 (1)

Stoich.:

A4B5C24D25 (1)

Weight, g/mol:

487.19302

ΔHf, kcal/mol:

-80.6

Dipole, Da:

7.42

IP(EA), eV:

 -9.16(-1.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(4R)-1-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2,3,4-trimethoxybenzamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2[C@]3(C1=O)[C@@H]4[C@H]([C@@H]5N3CCC5)C(=O)N(C4=O)C6=C(C(=CC=C6)[N+](=O)[O-])C

DOS

IR

Vibrations