Geometry & MOs

Info

ID:	368497
PubChem CID:	127329142
Reduced:	N3O3C13H21 (1)
Stoich.:	A3B3C13D21 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-97.82
Dipole, Da:	4.95
IP(EA), eV:	-9.68(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-5-methyl-1,2-oxazol-4-yl)-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)CCNC(=O)CC2CCOCC2

DOS

IR

Vibrations