Geometry & MOs

Info

ID:

424167

PubChem CID:

135121592

Reduced:

SO4N5H19C21 (1)

Stoich.:

AB4C5D19E21 (1)

Weight, g/mol:

471.163309

ΔHf, kcal/mol:

-56.06

Dipole, Da:

2.95

IP(EA), eV:

 -8.94(-1.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(2S)-1-[[(2S)-5-[[amino(nitramido)methylidene]amino]-1-(hydroxyamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-chlorobenzamide

Drug info:

PubChemData

Smile

CC(=O)N1CC(=O)N(C2=CC=CC=C21)CC3=NN=C(O3)SCC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations