Geometry & MOs

Info

ID:	285520
PubChem CID:	104109997
Reduced:	ClNC11H22 (1)
Stoich.:	ABC11D22 (1)
Weight, g/mol:	247.093933
ΔH_f, kcal/mol:	-57.3
Dipole, Da:	3.77
IP(EA), eV:	-8.98(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2,3-difluorophenyl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NC1CCCCC1

DOS

IR

Vibrations