Geometry & MOs

Info

ID:

226444

PubChem CID:

87352006

Reduced:

PtI2N3C20H33 (1)

Stoich.:

AB2C3D20E33 (1)

Weight, g/mol:

989.516346

ΔHf, kcal/mol:

77.8

Dipole, Da:

7.97

IP(EA), eV:

 -7.95(-3.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-1-[1-[(2R)-2-(dimethylamino)-2-phenylacetyl]-2-methylpyrrolidine-2-carbonyl]-N-[4-[2-[4-[[(2S)-1-[1-[(2R)-2-(dimethylamino)-2-phenylacetyl]-2-methylpyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]phenyl]-1,3-oxazol-5-yl]phenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(C(=[Pt])N1C2CCCCC2)C3CCCCC3.C1CC(C1)N(I)I

DOS

IR

Vibrations