Geometry & MOs

Info

ID:

177281

PubChem CID:

76159189

Reduced:

SN5O5C22H33 (1)

Stoich.:

AB5C5D22E33 (1)

Weight, g/mol:

543.309707

ΔHf, kcal/mol:

-154.69

Dipole, Da:

8.17

IP(EA), eV:

 -8.64(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[8-methoxy-4,7,10-trimethyl-11-oxo-5-(2-phenylethyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-15-yl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CC1CN(C(COC2=C(C=CC(=C2)NS(=O)(=O)C3=CN(C=N3)C)C(=O)N(CC1OC)C)C)C

DOS

IR

Vibrations