Geometry & MOs

Info

ID:	175399
PubChem CID:	75898027
Reduced:	NCl2O3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	325.14895
ΔH_f, kcal/mol:	-96.23
Dipole, Da:	1.29
IP(EA), eV:	-8.44(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2,5-difluorophenyl)ethyl-methylamino]-3-(furan-2-ylmethoxy)propan-2-ol

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC(=C1)Cl)Cl)CC(COC2=CC=C(C=C2)OC)O

DOS

IR

Vibrations