Geometry & MOs

Info

ID:	205021
PubChem CID:	80044972
Reduced:	SN2C18H22 (1)
Stoich.:	AB2C18D22 (1)
Weight, g/mol:	263.132157
ΔH_f, kcal/mol:	45.81
Dipole, Da:	2.43
IP(EA), eV:	-8.76(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-[1-[1-(furan-2-yl)propan-2-ylamino]ethyl]phenol

Drug info:

PubChemData

Smile

CNC1CCC(CC1SC2=CC=NC=C2)C3=CC=CC=C3

DOS

IR

Vibrations