Geometry & MOs

Info

ID:

7567

PubChem CID:

73422

Reduced:

ClNO5C18H22 (1)

Stoich.:

ABC5D18E22 (1)

Weight, g/mol:

367.118651

ΔHf, kcal/mol:

-137.84

Dipole, Da:

2.75

IP(EA), eV:

 -8.89(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,11R,13R,16S,18S)-18-methoxy-15-methyl-5,7,12-trioxa-15-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraen-11-ol;hydrochloride

Drug info:

PubChemData

Smile

CN1C[C@H]2[C@]3([C@@H]1C[C@@H](C=C3)OC)C4=CC5=C(C=C4[C@@H](O2)O)OCO5.Cl

DOS

IR

Vibrations