Geometry & MOs

Info

ID:	242202
PubChem CID:	96079578
Reduced:	FNOC14H14 (1)
Stoich.:	ABCD14E14 (1)
Weight, g/mol:	231.105942
ΔH_f, kcal/mol:	-55.77
Dipole, Da:	1.24
IP(EA), eV:	-8.14(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(5-amino-2-methylphenyl)-(2-fluorophenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)[C@H](C2=CC=CC=C2F)O

DOS

IR

Vibrations