Geometry & MOs

Info

ID:

232434

PubChem CID:

87576179

Reduced:

ZnO3C6H12 (1)

Stoich.:

AB3C6D12 (1)

Weight, g/mol:

1161.499192

ΔHf, kcal/mol:

-116.5

Dipole, Da:

3.61

IP(EA), eV:

-9.15(-1.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S)-2-[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]-N-formylanilino]-5-[2-[2-[2-[2-[2-[2-[[2-[4-[5-(morpholin-4-ylcarbamoylamino)-4-oxo-1H-indeno[1,2-c]pyrazol-3-yl]phenoxy]acetyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC(COC)OC(=O)C.[Zn]

DOS

IR

Vibrations