Geometry & MOs

Info

ID:	391132
PubChem CID:	135003041
Reduced:	BrPSiF2C30H36 (1)
Stoich.:	ABCD2E30F36 (1)
Weight, g/mol:	295.206678
ΔH_f, kcal/mol:	-73.33
Dipole, Da:	4.5
IP(EA), eV:	-8.83(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-chlorohexyl)-2,6-di(propan-2-yl)aniline

Drug info:

PubChemData

Smile

CC(C)[Si](C#CC(F)(F)P(C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)Br)(C(C)C)C(C)C

DOS

IR

Vibrations