Geometry & MOs

Info

ID:	160374
PubChem CID:	57309722
Reduced:	SF3O3N6C25H31 (1)
Stoich.:	AB3C3D6E25F31 (1)
Weight, g/mol:	636.356323
ΔH_f, kcal/mol:	-262.01
Dipole, Da:	3.92
IP(EA), eV:	-8.57(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[phenoxy-[phenoxy-phenyl-(2-piperidin-1-ylethoxy)methoxy]-phenylmethoxy]ethyl]piperidine

Drug info:

PubChemData

Smile

CCNC(=O)N(C1=C(C=CC(=C1)CN2CCC(C2)NC(=O)CNC(=O)C3=C(C=CC(=C3)C(F)(F)F)N)C)S

DOS

IR

Vibrations