Geometry & MOs

Info

ID:	432308
PubChem CID:	135172441
Reduced:	INO3C10H16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	340.38175
ΔH_f, kcal/mol:	-66.22
Dipole, Da:	4.46
IP(EA), eV:	-9.74(-2.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-N'-hexyl-N'-methyl-N,N-dipropylheptane-1,7-diamine

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CCCOCCCOI

DOS

IR

Vibrations