Geometry & MOs

Info

ID:	280930
PubChem CID:	103851992
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	259.11392
ΔH_f, kcal/mol:	-4.31
Dipole, Da:	1.89
IP(EA), eV:	-8.63(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-chloro-4-fluorophenyl)methylamino]-3-methylpentan-1-ol

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNC2CC(OC3=CC=CC=C23)(C)C

DOS

IR

Vibrations