Geometry & MOs

Info

ID:	249317
PubChem CID:	103088564
Reduced:	SN2C18H26 (1)
Stoich.:	AB2C18D26 (1)
Weight, g/mol:	267.176919
ΔH_f, kcal/mol:	23.12
Dipole, Da:	1.34
IP(EA), eV:	-8.47(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-5-methylsulfanyl-2-N-(2-pyridin-2-ylethyl)pentane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(C1=CC=CC2=CC=CC=C21)C(CCCSC)CN

DOS

IR

Vibrations