Geometry & MOs

Info

ID:	263658
PubChem CID:	103387345
Reduced:	NOC8H15 (2)
Stoich.:	ABC8D15 (2)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-135.49
Dipole, Da:	2.38
IP(EA), eV:	-9.12(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(3,4-dimethoxyphenyl)methyl]-5-methoxypentane-1,4-diamine

Drug info:

PubChemData

Smile

CC(CNC(=O)OC(C)(C)C)NCCC1=CCCCC1

DOS

IR

Vibrations