Geometry & MOs

Info

ID:	204153
PubChem CID:	79920157
Reduced:	NOC15H27 (1)
Stoich.:	ABC15D27 (1)
Weight, g/mol:	313.157246
ΔH_f, kcal/mol:	-92.97
Dipole, Da:	2.02
IP(EA), eV:	-9.31(2.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)sulfonyl]-1H-pyrazol-4-yl]methanamine

Drug info:

PubChemData

Smile

C1CCC2(CC1)CC(CCO2)C3CCCC3N

DOS

IR

Vibrations