Geometry & MOs

Info

ID:

215103

PubChem CID:

85084159

Reduced:

PN2O11C35H47 (1)

Stoich.:

AB2C11D35E47 (1)

Weight, g/mol:

702.261102

ΔHf, kcal/mol:

-494.34

Dipole, Da:

7.99

IP(EA), eV:

 -9.14(-0.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[4-acetyloxy-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-2-yl]-2-oxopyrimidin-4-yl]sulfanylmethyl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CCOP(=O)(C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)N3C(COC3(C)C)C4=CC=CC=C4)CCC5(OCCO5)COC(=O)C)OCC

DOS

IR

Vibrations