Geometry & MOs

Info

ID:	294071
PubChem CID:	117426288
Reduced:	NF2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	269.122735
ΔH_f, kcal/mol:	-167.22
Dipole, Da:	3.98
IP(EA), eV:	-8.84(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclohexyl]methanamine

Drug info:

PubChemData

Smile

C1CC(NC1)CC2=CC3=C(C=C2C(F)F)OCCO3

DOS

IR

Vibrations