Geometry & MOs

Info

ID:

173382

PubChem CID:

75631820

Reduced:

N2O11C21H34 (1)

Stoich.:

A2B11C21D34 (1)

Weight, g/mol:

1034.443085

ΔHf, kcal/mol:

-488.02

Dipole, Da:

1.64

IP(EA), eV:

-9.18(-0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-methoxy-5-[[[6-methoxy-5-[[[6-methoxy-5-[[[6-methoxy-2,2-dimethyl-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-5-carbonyl]amino]methyl]-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-5-carbonyl]amino]methyl]-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-5-carbonyl]amino]methyl]-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1(OC2C(C(OC2O1)(CN)C(=O)NCC3(C(C4C(O3)OC(O4)(C)C)OC)C(=O)OC)OC)C

DOS

IR

Vibrations