Geometry & MOs

Info

ID:

337575

PubChem CID:

127258198

Reduced:

N3O7C18H21 (1)

Stoich.:

A3B7C18D21 (1)

Weight, g/mol:

693.26863

ΔHf, kcal/mol:

-269.29

Dipole, Da:

3.01

IP(EA), eV:

 -9.5(-0.94)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-benzyl-1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-3-methoxyoxolan-2-yl]-2,4-dioxopyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CO[C@@H]1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C(=O)NCC3=CC=CC=C3)CO)O

DOS

IR

Vibrations