Geometry & MOs

Info

ID:	12441
PubChem CID:	137819
Reduced:	NO4C24H27 (1)
Stoich.:	AB4C24D27 (1)
Weight, g/mol:	393.194008
ΔH_f, kcal/mol:	-98.21
Dipole, Da:	2.76
IP(EA), eV:	-8.79(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(N-(2-hydroxy-3-phenoxypropyl)anilino)-3-phenoxypropan-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

DOS

IR

Vibrations