Geometry & MOs

Info

ID:	290260
PubChem CID:	104424002
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	230.235814
ΔH_f, kcal/mol:	-77.93
Dipole, Da:	1.78
IP(EA), eV:	-8.15(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methylpropyl)-N-(3-propoxypropyl)propane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)CNCCCNCC1=C(C=CC(=C1)OC)OC

DOS

IR

Vibrations