Geometry & MOs

Info

ID:

44644

PubChem CID:

10504693

Reduced:

N4O7C23H30 (1)

Stoich.:

A4B7C23D30 (1)

Weight, g/mol:

474.211449

ΔHf, kcal/mol:

-264.82

Dipole, Da:

4.75

IP(EA), eV:

 -9.38(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2R)-2-[(3R,5R)-2-benzyl-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-1,2-oxazolidin-3-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H](N(O2)CC3=CC=CC=C3)[C@@H](C(=O)OC)NC(=O)OC(C)(C)C

DOS

IR

Vibrations