Geometry & MOs

Info

ID:

224053

PubChem CID:

85337593

Reduced:

O2N8C29H34 (1)

Stoich.:

A2B8C29D34 (1)

Weight, g/mol:

527.277755

ΔHf, kcal/mol:

52.97

Dipole, Da:

5.93

IP(EA), eV:

 -8.11(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

S-[2-[[2-amino-4-(3,4,4-trimethyl-2,5-dioxoimidazolidin-1-yl)pentanoyl]-butanoylamino]-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl] ethanethioate

Drug info:

PubChemData

Smile

CN1CCCN(CC1)C2=CC=C(C=C2)C3C4C(C5=C(C4=O)C(=CC=C5)NC(=O)NN(C)C6=CC=CC=N6)NN3

DOS

IR

Vibrations