Geometry & MOs

Info

ID:	403979
PubChem CID:	135063911
Reduced:	NSi2O3C20H43 (1)
Stoich.:	AB2C3D20E43 (1)
Weight, g/mol:	293.02639
ΔH_f, kcal/mol:	-281.17
Dipole, Da:	2.93
IP(EA), eV:	-8.89(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2,3,4,5,6-pentafluorophenyl)ethynyl]benzonitrile

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCN1CCC(=O)CC1CO[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations