Geometry & MOs

Info

ID:

445556

PubChem CID:

135268032

Reduced:

N3O3C8H15 (1)

Stoich.:

A3B3C8D15 (1)

Weight, g/mol:

673.347549

ΔHf, kcal/mol:

-110.63

Dipole, Da:

2.63

IP(EA), eV:

-9.63(-0.3)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[1-[[(2S)-1-[[4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

C(CNC(=O)CC(C=O)N)C(C=O)N

DOS

IR

Vibrations