Geometry & MOs

Info

ID:	436799
PubChem CID:	135211599
Reduced:	BrNSO2C33H50 (2)
Stoich.:	ABCD2E33F50 (2)
Weight, g/mol:	270.247638
ΔH_f, kcal/mol:	-206.54
Dipole, Da:	3.8
IP(EA), eV:	-8.02(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,6,6-tetraethyl-1,3,4,5-tetramethylphosphinane

Drug info:

PubChemData

Smile

CCCCCCCCC(CCCCCC)CN1C(C2=C(N(C(=O)C2=C1C3=CC=C(O3)C4=CC(=C(S4)Br)CCCCCC)CC(CCCCCC)CCCCCCCC)C5=CC=C(O5)C6=CC(=C(S6)Br)CCCCCC)O

DOS

IR

Vibrations