Geometry & MOs

Info

ID:	203675
PubChem CID:	79858307
Reduced:	SN2O3C12H22 (1)
Stoich.:	AB2C3D12E22 (1)
Weight, g/mol:	262.171499
ΔH_f, kcal/mol:	-100.53
Dipole, Da:	6.12
IP(EA), eV:	-8.91(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N'-methyl-N'-(2-methylsulfonylethyl)pentane-1,5-diamine

Drug info:

PubChemData

Smile

CCNCC1=CC=C(O1)CN(C)CCS(=O)(=O)C

DOS

IR

Vibrations