Geometry & MOs

Info

ID:	163653
PubChem CID:	58106543
Reduced:	FSH15C23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	314.05655
ΔH_f, kcal/mol:	61.41
Dipole, Da:	1.26
IP(EA), eV:	-8.46(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-14-methyl-13-thiahexacyclo[9.8.2.02,7.08,20.012,16.017,21]henicosa-1,3,5,7,9,11,14,16,18,20-decaene

Drug info:

PubChemData

Smile

CC1=CC=C(C2=C3C=CC4=C5C(=C6C4=C3C(=C12)C=C6)C(=C(S5)C)F)C

DOS

IR

Vibrations