Geometry & MOs

Info

ID:	401038
PubChem CID:	135049874
Reduced:	ClNO2H14C17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	699.218729
ΔH_f, kcal/mol:	-7.87
Dipole, Da:	6.89
IP(EA), eV:	-9.62(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[bis[di(propan-2-yl)amino]phosphanyl-phosphanylidenemethyl]-N-propan-2-ylpropan-2-amine;carbon monoxide;tungsten

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)C(C#N)C(C2=CC=CC=C2)Cl

DOS

IR

Vibrations