Geometry & MOs

Info

ID:	397343
PubChem CID:	135030076
Reduced:	O2Si2C27H40 (1)
Stoich.:	A2B2C27D40 (1)
Weight, g/mol:	350.163043
ΔH_f, kcal/mol:	-117.86
Dipole, Da:	2.89
IP(EA), eV:	-8.86(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,10R,12S,13E,20R)-13-ethylidene-17-oxa-8,15-diazahexacyclo[10.7.1.01,9.02,7.010,15.014,19]icosa-2,4,6,8-tetraene-20-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(C)[Si](C(C)C)(C(C)C)OC1=CCC(=C(C1)C#C[Si](C)(C)C)C(=O)C2=CC=CC=C2

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)[Si](C(C)C)(C(C)C)OC1=CCC(=C(C1)C#C[Si](C)(C)C)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):