Geometry & MOs

Info

ID:	411163
PubChem CID:	135083974
Reduced:	NP2F9C18H22 (1)
Stoich.:	AB2C9D18E22 (1)
Weight, g/mol:	561.139677
ΔH_f, kcal/mol:	-515.7
Dipole, Da:	2.68
IP(EA), eV:	-8.21(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-ditert-butyl-N-methyl-N-[2,4,6-tris(trifluoromethyl)phenyl]phosphanylidenephosphanylaniline

Drug info:

PubChemData

Smile

CC1(CCCC(N1P=PC2=C(C=C(C=C2C(F)(F)F)C(F)(F)F)C(F)(F)F)(C)C)C

DOS

IR

Vibrations