Geometry & MOs

Info

ID:	288490
PubChem CID:	104317507
Reduced:	FNOC12H18 (1)
Stoich.:	ABCD12E18 (1)
Weight, g/mol:	175.157229
ΔH_f, kcal/mol:	-93.3
Dipole, Da:	0.53
IP(EA), eV:	-9.0(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-hydroxybutylamino)pentan-2-ol

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1F)NCCC(C)O

DOS

IR

Vibrations