Geometry & MOs

Info

ID:	397399
PubChem CID:	135030163
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	911.392555
ΔH_f, kcal/mol:	15.69
Dipole, Da:	6.94
IP(EA), eV:	-9.59(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-[[(2S,3R)-3-azido-4-[tert-butyl(diphenyl)silyl]oxy-2-hydroxybutyl]amino]-3-[(2S,3R,4R,5R)-5-[(1,3-dioxoisoindol-2-yl)methyl]-3,4-bis(phenylmethoxy)oxolan-2-yl]propanoate

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)C1=CC=C(C=C1)C(C)(CC2=CN=CC=C2)[N+](=O)[O-]

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)C1=CC=C(C=C1)C(C)(CC2=CN=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):