Geometry & MOs

Info

ID:	400168
PubChem CID:	135046164
Reduced:	O5C22H28 (1)
Stoich.:	A5B22C28 (1)
Weight, g/mol:	905.565722
ΔH_f, kcal/mol:	-136.19
Dipole, Da:	1.01
IP(EA), eV:	-8.74(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-benzyl-3-[(2R)-2-[(2S,4S,5R,6S)-6-[(2S,6R,7S,8S,9R)-6,8-dimethyl-4-methylidene-5-oxo-7-triethylsilyloxy-9-tri(propan-2-yl)silyloxydecan-2-yl]-5-methyl-2-phenyl-1,3-dioxan-4-yl]propanoyl]-1,3-oxazolidin-2-one

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

C[C@H]1[C@H](O1)[C@H](COCC2=CC=C(C=C2)OC)COCOCC3=CC=CC=C3

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

C[C@H]1[C@H](O1)[C@H](COCC2=CC=C(C=C2)OC)COCOCC3=CC=CC=C3

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):