Geometry & MOs

Info

ID:	163652
PubChem CID:	58106541
Reduced:	SH10C16 (2)
Stoich.:	AB10C16 (2)
Weight, g/mol:	342.08785
ΔH_f, kcal/mol:	202.04
Dipole, Da:	0.28
IP(EA), eV:	-7.62(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-fluoro-3,6,14-trimethyl-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(C=C1)C2=CC3=C4C=CC5=C6C(=C7C5=C4C(=C3S2)C=C7)C=C(S6)C8=CC=C(C=C8)C

DOS

IR

Vibrations