Geometry & MOs

Info

ID:	29523
PubChem CID:	834708
Reduced:	N6C15H22 (1)
Stoich.:	A6B15C22 (1)
Weight, g/mol:	279.108171
ΔH_f, kcal/mol:	87.61
Dipole, Da:	9.5
IP(EA), eV:	-8.33(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylsulfanylphenyl)methyl]naphthalen-1-amine

Drug info:

PubChemData

Smile

CCCN1C(=NN=N1)NCC2=CC=C(C=C2)N3CCCC3

DOS

IR

Vibrations