Geometry & MOs

Info

ID:

376271

PubChem CID:

134222281

Reduced:

N2H22C35 (3)

Stoich.:

A2B22C35 (3)

Weight, g/mol:

234.938671

ΔHf, kcal/mol:

526.67

Dipole, Da:

1.12

IP(EA), eV:

 -8.28(-1.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(difluorophosphorylamino)-fluorophosphoryl]-trifluoromethane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C4=C3C=C(C=C4)C5=CC=CC=C5)CC6=C(C(=C(C(=C6N7C8=C(C=C(C=C8)C9=CC=CC=C9)C1=C7C=CC(=C1)C1=CC=CC=C1)C#N)N1C2=C(C=C(C=C2)C2=CC=CC=C2)C2=C1C=CC(=C2)C1=CC=CC=C1)N1C2=C(C=C(C=C2)C2=CC=CC=C2)C2=C1C=CC(=C2)C1=CC=CC=C1)C#N

DOS

IR

Vibrations