Geometry & MOs

Info

ID:	279796
PubChem CID:	103845210
Reduced:	ON4C12H22 (1)
Stoich.:	AB4C12D22 (1)
Weight, g/mol:	253.103355
ΔH_f, kcal/mol:	-27.86
Dipole, Da:	6.85
IP(EA), eV:	-9.07(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-fluorophenyl)-N-[(1-cyclopropylcyclopropyl)methyl]methanamine

Drug info:

PubChemData

Smile

CCN1C(=CC=N1)CNCC(C)(C)C(=O)NC

DOS

IR

Vibrations