Geometry & MOs

Info

ID:	260883
PubChem CID:	103208116
Reduced:	ON2F3C11H23 (1)
Stoich.:	AB2C3D11E23 (1)
Weight, g/mol:	380.05162
ΔH_f, kcal/mol:	-230.73
Dipole, Da:	0.33
IP(EA), eV:	-8.96(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(3-chloro-4-iodophenyl)methyl]-1-N-(2-methylpropyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)CNCC(C)NCCOCC(F)(F)F

DOS

IR

Vibrations