Geometry & MOs

Info

ID:	270175
PubChem CID:	103631851
Reduced:	OSN2C11H20 (1)
Stoich.:	ABC2D11E20 (1)
Weight, g/mol:	235.193614
ΔH_f, kcal/mol:	-30.89
Dipole, Da:	2.3
IP(EA), eV:	-8.96(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dimethylphenyl)methyl]-5-methoxypentan-1-amine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CNCCCCCOC

DOS

IR

Vibrations