Geometry & MOs

Info

ID:	246311
PubChem CID:	103059173
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	294.210742
ΔH_f, kcal/mol:	-32.77
Dipole, Da:	1.44
IP(EA), eV:	-8.93(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(N-ethyl-3-fluoroanilino)methyl]-N-propyloxan-4-amine

Drug info:

PubChemData

Smile

CC1CC(CC(C1)OCC2=CN=C(C=N2)N)C

DOS

IR

Vibrations