Geometry & MOs

Info

ID:	281778
PubChem CID:	103914351
Reduced:	SN2O2C13H28 (1)
Stoich.:	AB2C2D13E28 (1)
Weight, g/mol:	264.187149
ΔH_f, kcal/mol:	-114.97
Dipole, Da:	4.97
IP(EA), eV:	-8.44(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N-(1-ethylsulfonylpropan-2-yl)-N'-propylethane-1,2-diamine

Drug info:

PubChemData

Smile

CCCN(CC)CCNC1CCCC1S(=O)(=O)C

DOS

IR

Vibrations