Geometry & MOs

Info

ID:	267135
PubChem CID:	103580955
Reduced:	NOC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	260.132491
ΔH_f, kcal/mol:	-83.06
Dipole, Da:	6.3
IP(EA), eV:	-9.24(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2-cyclopropyloxolan-3-yl)amino]methyl]-2-fluorobenzonitrile

Drug info:

PubChemData

Smile

CCN(C)C(=O)CNC1CCOC1C2CC2

DOS

IR

Vibrations