Geometry & MOs

Info

ID:	393558
PubChem CID:	135021035
Reduced:	N3O3H17C25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	196.126343
ΔH_f, kcal/mol:	52.35
Dipole, Da:	4.46
IP(EA), eV:	-9.26(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-fluoro-4-methyl-3-phenylpentan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=NC2=CC=CC=C12)C3=C(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5

DOS

IR

Vibrations