Geometry & MOs

Info

ID:	215136
PubChem CID:	85084208
Reduced:	SiO3C20H39 (2)
Stoich.:	AB3C20D39 (2)
Weight, g/mol:	712.476163
ΔH_f, kcal/mol:	-459.73
Dipole, Da:	4.73
IP(EA), eV:	-8.71(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[22-(7-acetyloxy-3-hydroxy-5-methyldec-4-en-2-yl)-4,8,12,20-tetrahydroxy-3,5,15-trimethyl-2-oxo-1-oxacyclodocos-15-en-10-yl] acetate

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

CCOC(C)OC1C(=CCCC=C2CCCC(C2OC(C)OCC)(C)CO[Si](C)(C)C(C)(C)C)CCCC1(C)CO[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

CCOC(C)OC1C(=CCCC=C2CCCC(C2OC(C)OCC)(C)CO[Si](C)(C)C(C)(C)C)CCCC1(C)CO[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):