Geometry & MOs

Info

ID:	214994
PubChem CID:	85083969
Reduced:	Si3O7C34H58 (1)
Stoich.:	A3B7C34D58 (1)
Weight, g/mol:	663.153858
ΔH_f, kcal/mol:	-436.12
Dipole, Da:	3.25
IP(EA), eV:	-9.36(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-(2-methoxy-2-oxoethyl)-1-(9-phenylfluoren-9-yl)-4-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-2-carboxylate

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

CC(C1C(O1)CC2COC(C(C2O[Si](C)(C)C)O[Si](C)(C)C)CC(=CC(=O)C=C(C3=CC=CC=C3)O)C)C(C)O[Si](C)(C)C

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

CC(C1C(O1)CC2COC(C(C2O[Si](C)(C)C)O[Si](C)(C)C)CC(=CC(=O)C=C(C3=CC=CC=C3)O)C)C(C)O[Si](C)(C)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):