Geometry & MOs

Info

ID:	246351
PubChem CID:	103059353
Reduced:	ClFON3C14H15 (1)
Stoich.:	ABCD3E14F15 (1)
Weight, g/mol:	270.230728
ΔH_f, kcal/mol:	-37.15
Dipole, Da:	6.95
IP(EA), eV:	-8.88(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[methyl(oxolan-2-ylmethyl)amino]methyl]-N-propyloxan-4-amine

Drug info:

PubChemData

Smile

CCCNC1=NC=C(N=C1)COC2=CC(=C(C=C2)Cl)F

DOS

IR

Vibrations