Geometry & MOs

Info

ID:	329039
PubChem CID:	126730750
Reduced:	N4O6C19H32 (1)
Stoich.:	A4B6C19D32 (1)
Weight, g/mol:	1140.116679
ΔH_f, kcal/mol:	-257.2
Dipole, Da:	6.28
IP(EA), eV:	-9.27(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4,5-tetrafluoro-3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(4-methylphenoxy)phenyl]phenoxy]phenyl]propan-2-yl]phenoxy]-6-[2,3,5,6-tetrafluoro-4-(4-methylphenoxy)phenyl]benzene

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC(=C)C(=O)N(C)CCOC(=O)NCCCNC(=O)OCCN(C)C(=O)C(=C)C

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

CC(=C)C(=O)N(C)CCOC(=O)NCCCNC(=O)OCCN(C)C(=O)C(=C)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):