Geometry & MOs

Info

ID:	408595
PubChem CID:	135081362
Reduced:	BiO2Cl6H15C22 (1)
Stoich.:	AB2C6D15E22 (1)
Weight, g/mol:	891.17127
ΔH_f, kcal/mol:	109.0
Dipole, Da:	9.48
IP(EA), eV:	-8.36(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4,4-dimethyl-1,3-oxazolidin-2-yl)phenyl]-(4-methoxyphenyl)-(4-methylphenyl)sulfonyloxy-thiophen-2-yl-[4-(trifluoromethyl)phenyl]bismuth

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C1=CC=C(C=C1)[Bi](C2=CC=CC=C2)(C3=CC=CC=C3)(C(=O)C(Cl)(Cl)Cl)C(=O)C(Cl)(Cl)Cl

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C1=CC=C(C=C1)[Bi](C2=CC=CC=C2)(C3=CC=CC=C3)(C(=O)C(Cl)(Cl)Cl)C(=O)C(Cl)(Cl)Cl

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):