Geometry & MOs

Info

ID:	201525
PubChem CID:	79551032
Reduced:	SO2N3C12H23 (1)
Stoich.:	AB2C3D12E23 (1)
Weight, g/mol:	245.119798
ΔH_f, kcal/mol:	-75.89
Dipole, Da:	5.72
IP(EA), eV:	-9.06(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[3-(2-methyl-2-methylsulfonylpropyl)imidazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CCCNCC1=CN=CN1CC(C)(C)S(=O)(=O)C

DOS

IR

Vibrations