Geometry & MOs

Info

ID:

189501

PubChem CID:

77866487

Reduced:

ClN2O3C24H31 (1)

Stoich.:

AB2C3D24E31 (1)

Weight, g/mol:

498.243765

ΔHf, kcal/mol:

-143.14

Dipole, Da:

4.13

IP(EA), eV:

 -9.1(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]-2-methylpropan-2-yl]-hydroxy-diphenylsilane

Drug info:

PubChemData

Smile

C1CC2CC(C1)CC(C2)CC(=O)NC3=C(C=CC4=C3C=CC(=N4)CCC(CO)O)Cl

DOS

IR

Vibrations