Geometry & MOs

Info

ID:	362436
PubChem CID:	127307782
Reduced:	SN3O3C19H21 (1)
Stoich.:	AB3C3D19E21 (1)
Weight, g/mol:	359.141596
ΔH_f, kcal/mol:	-70.91
Dipole, Da:	1.23
IP(EA), eV:	-9.37(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-pyrazin-2-ylpiperidin-4-yl)-[2-(1,3-thiazol-2-yl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)C(=O)NCC(=O)N3CCOC(C3)C4=NC=CS4

DOS

IR

Vibrations