Geometry & MOs

Info

ID:	201076
PubChem CID:	79486401
Reduced:	FNOSC16H20 (1)
Stoich.:	ABCDE16F20 (1)
Weight, g/mol:	295.079763
ΔH_f, kcal/mol:	-54.66
Dipole, Da:	1.81
IP(EA), eV:	-8.3(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-chloro-4-[methyl(2-thiophen-2-ylethyl)amino]phenyl]ethanol

Drug info:

PubChemData

Smile

CC(CC1=CC=CS1)N(C)C2=C(C(=CC=C2)F)C(C)O

DOS

IR

Vibrations