Geometry & MOs

Info

ID:	204199
PubChem CID:	79930640
Reduced:	SN3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	268.189926
ΔH_f, kcal/mol:	-11.18
Dipole, Da:	5.48
IP(EA), eV:	-8.49(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1CCCC(=S)N

DOS

IR

Vibrations