Geometry & MOs

Info

ID:	354327
PubChem CID:	127286453
Reduced:	SN3O4C15H19 (1)
Stoich.:	AB3C4D15E19 (1)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-154.48
Dipole, Da:	6.6
IP(EA), eV:	-9.57(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C2=CC=CC=C2C1NC(=O)N3CCC(=O)NCC3

DOS

IR

Vibrations