Geometry & MOs

Info

ID:

148216

PubChem CID:

53787878

Reduced:

Si2O6C39H70 (1)

Stoich.:

A2B6C39D70 (1)

Weight, g/mol:

228.085855

ΔHf, kcal/mol:

-451.29

Dipole, Da:

5.15

IP(EA), eV:

 -8.4(0.57)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[2-(2-hydroxyethylamino)-2-oxoethyl]amino]-N-methoxy-2-oxoethanimidoyl cyanide

Drug info:

PubChemData

Smile

CCCC(C)(CCC)C(=O)O[C@H]1C[C@@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations