Geometry & MOs

Info

ID:	218451
PubChem CID:	85089465
Reduced:	ISiC24H25 (1)
Stoich.:	ABC24D25 (1)
Weight, g/mol:	486.218843
ΔH_f, kcal/mol:	66.02
Dipole, Da:	2.3
IP(EA), eV:	-9.11(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

22-(benzenesulfonyl)-5,7-dioxa-11,22-diazahexacyclo[11.11.0.02,10.04,8.015,23.016,21]tetracosan-12-one

Drug info:

PubChemData

Smile

CCCCC=C([Si](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)I

DOS

IR

Vibrations