Geometry & MOs

Info

ID:	288513
PubChem CID:	104317947
Reduced:	FNOSC10H14 (1)
Stoich.:	ABCDE10F14 (1)
Weight, g/mol:	211.103085
ΔH_f, kcal/mol:	-92.21
Dipole, Da:	3.35
IP(EA), eV:	-8.57(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-amino-3-methylphenyl)sulfanylbutan-2-ol

Drug info:

PubChemData

Smile

CC(CCSC1=CC(=CC(=C1)F)N)O

DOS

IR

Vibrations