Geometry & MOs

Info

ID:	390321
PubChem CID:	134998468
Reduced:	NOC12H12 (2)
Stoich.:	ABC12D12 (2)
Weight, g/mol:	360.092515
ΔH_f, kcal/mol:	37.27
Dipole, Da:	5.32
IP(EA), eV:	-8.74(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[bis(2,2,2-trifluoroethoxy)phosphoryl]heptan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)N2[C]ON(C2C3=CC=C(C=C3)OC)CC4=CC=CC=C4)C

DOS

IR

Vibrations