Geometry & MOs

Info

ID:	204154
PubChem CID:	79920413
Reduced:	SO2N5C13H23 (1)
Stoich.:	AB2C5D13E23 (1)
Weight, g/mol:	293.283098
ΔH_f, kcal/mol:	-48.83
Dipole, Da:	4.67
IP(EA), eV:	-8.83(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,2-dimethyl-1-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)cyclohexyl]methanamine

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1S(=O)(=O)C3=C(C=NN3)CN

DOS

IR

Vibrations