Geometry & MOs

Info

ID:

320874

PubChem CID:

126664014

Reduced:

F2O4C23H30 (1)

Stoich.:

A2B4C23D30 (1)

Weight, g/mol:

641.181645

ΔHf, kcal/mol:

-283.32

Dipole, Da:

2.74

IP(EA), eV:

 -9.8(-0.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S,6Z,9S)-6-[amino(phenylmethoxy)methylidene]-14-chloro-15-(dimethoxymethyl)-17-phenylmethoxy-3-oxapentacyclo[9.8.0.02,4.04,9.013,18]nonadeca-1,13,15,17-tetraene-5,7,19-trione

Drug info:

PubChemData

Smile

CCC1(CC2CC(CC(C2)C1)C)C(=O)OC(C3=CC=CC=C3)C(C(=O)OC)(F)F

DOS

IR

Vibrations