Geometry & MOs

Info

ID:

411777

PubChem CID:

135084622

Reduced:

ClSN2O5C35H37 (1)

Stoich.:

ABC2D5E35F37 (1)

Weight, g/mol:

772.26621

ΔHf, kcal/mol:

-110.06

Dipole, Da:

12.85

IP(EA), eV:

 -7.97(-1.18)

Spin(Sz, S2):

 None, None

Charge, e:

 -1

Chem-info

IUPAC name:

2,3-bis[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-yl]-1-benzothiophene;(1Z,5Z)-cycloocta-1,5-diene;rhodium;tetrafluoroborate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](C2CC3CC[N+]2(CC3C=C)CC4=C(C(=CC(=C4)C)C=O)O)C5=CC=NC6=CC=CC=C56.[Cl-]

DOS

IR

Vibrations