Geometry & MOs

Info

ID:	174227
PubChem CID:	75743679
Reduced:	N2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	266.18167
ΔH_f, kcal/mol:	6.35
Dipole, Da:	3.53
IP(EA), eV:	-8.72(0.2)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

(1-ethylpyrrolidin-1-ium-2-yl)methyl-[(4-methylsulfanylphenyl)methyl]azanium

Drug info:

PubChemData

Smile

CC[NH+]1CCCC1C[NH2+]CC2=CC=CC=C2C

DOS

IR

Vibrations