Geometry & MOs

Info

ID:

168598

PubChem CID:

74992714

Reduced:

NO13C40H53 (1)

Stoich.:

AB13C40D53 (1)

Weight, g/mol:

499.268236

ΔHf, kcal/mol:

-486.37

Dipole, Da:

14.05

IP(EA), eV:

 -9.66(-0.57)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl N-[1-[[1-(hydroxyamino)-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C(C)(C)C)NC(=O)C5CC5)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O

DOS

IR

Vibrations