Geometry & MOs

Info

ID:

382187

PubChem CID:

134973165

Reduced:

NOC9H10 (2)

Stoich.:

ABC9D10 (2)

Weight, g/mol:

1120.357214

ΔHf, kcal/mol:

-22.84

Dipole, Da:

6.81

IP(EA), eV:

-9.36(-0.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[13-[1-[(5R,6S)-6-[[10,16-bis(trimethylsilyl)-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl]oxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethoxy]-16-trimethylsilyl-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-10-yl]-trimethylsilane

Drug info:

PubChemData

Smile

C1[C@@H]([C@@H](C(=O)O1)NCC2=CC=CC=C2)NCC3=CC=CC=C3

DOS

IR

Vibrations