Geometry & MOs

Info

ID:	368517
PubChem CID:	127329338
Reduced:	SN2O3C14H24 (1)
Stoich.:	AB2C3D14E24 (1)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-147.41
Dipole, Da:	6.94
IP(EA), eV:	-9.05(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-(3-methyl-6-phenyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3CCS(=O)(=O)C3

DOS

IR

Vibrations