Geometry & MOs

Info

ID:	44135
PubChem CID:	10501041
Reduced:	SF3O5C17H25 (1)
Stoich.:	AB3C5D17E25 (1)
Weight, g/mol:	398.199428
ΔH_f, kcal/mol:	-367.62
Dipole, Da:	5.22
IP(EA), eV:	-9.33(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-diphenylethylamino)-3-quinolin-5-yloxypropan-2-ol

Drug info:

PubChemData

Smile

CCOC(=O)/C=C(\CC/C=C(\C)/CCC=C(C)C)/OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations