Geometry & MOs

Info

ID:	407210
PubChem CID:	135079566
Reduced:	SN2Si2O4C21H34 (1)
Stoich.:	AB2C2D4E21F34 (1)
Weight, g/mol:	341.108565
ΔH_f, kcal/mol:	-189.48
Dipole, Da:	3.51
IP(EA), eV:	-7.99(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-phenylhex-1-yn-3-ylideneamino) 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CC(=C)C1=NC(=CO1)C(=O)/C=C\2/NC(=C(S2)[Si](C)(C)C)COCOCC[Si](C)(C)C

DOS

IR

Vibrations