Geometry & MOs

Info

ID:

340614

PubChem CID:

127262625

Reduced:

NSO2H21C23 (1)

Stoich.:

ABC2D21E23 (1)

Weight, g/mol:

954.28366

ΔHf, kcal/mol:

-8.01

Dipole, Da:

6.78

IP(EA), eV:

-9.28(-0.4)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

acetonitrile;ditert-butyl-[2,3,4,5-tetramethyl-6-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphanium;gold;hexafluoroantimony(1-)

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C3CC4=CC=CC=C4C2(C5=CC=CC=C35)C

DOS

IR

Vibrations