Geometry & MOs

Info

ID:	203693
PubChem CID:	79859047
Reduced:	SN2O3C14H24 (1)
Stoich.:	AB2C3D14E24 (1)
Weight, g/mol:	262.171499
ΔH_f, kcal/mol:	-104.53
Dipole, Da:	3.35
IP(EA), eV:	-8.9(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N'-methyl-N'-(2-methylsulfonylethyl)propane-1,3-diamine

Drug info:

PubChemData

Smile

CNCC1=CC(=CC=C1)OCCN(C)CCS(=O)(=O)C

DOS

IR

Vibrations