Geometry & MOs

Info

ID:	246212
PubChem CID:	103049728
Reduced:	ClFNOC15H23 (1)
Stoich.:	ABCDE15F23 (1)
Weight, g/mol:	313.16087
ΔH_f, kcal/mol:	-99.49
Dipole, Da:	1.57
IP(EA), eV:	-8.88(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(5-chloro-2-fluorophenyl)methyl]oxan-4-yl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)C(CC1=C(C=CC(=C1)Cl)F)CNCCOC

DOS

IR

Vibrations