Geometry & MOs

Info

ID:	387714
PubChem CID:	134986556
Reduced:	SO4C13H24 (1)
Stoich.:	AB4C13D24 (1)
Weight, g/mol:	236.026502
ΔH_f, kcal/mol:	-211.89
Dipole, Da:	1.68
IP(EA), eV:	-9.08(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-4-cyanoimino-5-fluoro-3,6-dimethylcyclohexa-2,5-dien-1-ylidene)cyanamide

Drug info:

PubChemData

Smile

CCCCCCCCS[C@@H](C(=O)OC)OC(=O)C

DOS

IR

Vibrations