Geometry & MOs

Info

ID:	84393
PubChem CID:	49866191
Reduced:	FON2H19C20 (1)
Stoich.:	ABC2D19E20 (1)
Weight, g/mol:	313.204179
ΔH_f, kcal/mol:	-17.39
Dipole, Da:	5.83
IP(EA), eV:	-9.04(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(dimethylamino)phenyl]phenyl]hexane-1,6-diol

Drug info:

PubChemData

Smile

C1CNCC1(CC2=CC=CC=C2)C(=O)C3=CC(=C4C(=C3)C=CN4)F

DOS

IR

Vibrations