Geometry & MOs

Info

ID:	220211
PubChem CID:	85165368
Reduced:	NSSi3O6C32H63 (1)
Stoich.:	ABC3D6E32F63 (1)
Weight, g/mol:	674.543913
ΔH_f, kcal/mol:	-457.46
Dipole, Da:	2.3
IP(EA), eV:	-8.8(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[bis(3,7,7-trimethyl-2-bicyclo[4.1.0]heptanyl)boranyloxy]-2-methylsulfanylethenoxy]-bis(3,7,7-trimethyl-2-bicyclo[4.1.0]heptanyl)borane

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(C)(C)OC(=O)NC(CO[Si](C)(C)C(C)(C)C)C(C(C(=O)C1=CC=CS1)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(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(C)(C)OC(=O)NC(CO[Si](C)(C)C(C)(C)C)C(C(C(=O)C1=CC=CS1)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):