Geometry & MOs

Info

ID:	413584
PubChem CID:	135086533
Reduced:	SF6H8C10 (1)
Stoich.:	AB6C8D10 (1)
Weight, g/mol:	302.22458
ΔH_f, kcal/mol:	-277.2
Dipole, Da:	4.52
IP(EA), eV:	-9.61(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,7-dien-4-yne-1,6-diol

Drug info:

PubChemData

Smile

C1C2C=CC1C3C2C(S3)(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations