Geometry & MOs

Info

ID:	258245
PubChem CID:	103152242
Reduced:	NF3O4C13H20 (1)
Stoich.:	AB3C4D13E20 (1)
Weight, g/mol:	158.141913
ΔH_f, kcal/mol:	-366.36
Dipole, Da:	8.55
IP(EA), eV:	-10.22(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-2-methoxybutane-1,4-diamine

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)C1CCCC(C1)C(F)(F)F

DOS

IR

Vibrations