Geometry & MOs

Info

ID:	49624
PubChem CID:	11533399
Reduced:	ClN3H26C33 (1)
Stoich.:	AB3C26D33 (1)
Weight, g/mol:	498.168622
ΔH_f, kcal/mol:	128.41
Dipole, Da:	2.38
IP(EA), eV:	-8.22(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trichloro-[15-[dimethyl(3,3,3-trifluoropropyl)silyl]pentadecyl]silane

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C(CC(C3=CNC4=CC=CC=C43)C5=CNC6=CC=CC=C65)C7=CC=CC=C7Cl

DOS

IR

Vibrations