Geometry & MOs

Info

ID:	249351
PubChem CID:	103088833
Reduced:	FSCl2N2O2C13H15 (1)
Stoich.:	ABC2D2E2F13G15 (1)
Weight, g/mol:	244.19732
ΔH_f, kcal/mol:	-120.26
Dipole, Da:	3.6
IP(EA), eV:	-9.23(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(cyclopentylmethyl)-2-N-methyl-5-methylsulfanylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CC1CC2CNCC2N1S(=O)(=O)C3=C(C(=C(C=C3)Cl)F)Cl

DOS

IR

Vibrations