Geometry & MOs

Info

ID:	367528
PubChem CID:	127324888
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-113.46
Dipole, Da:	5.96
IP(EA), eV:	-8.74(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-phenylthiomorpholin-4-yl)-(3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)N3CCSCC3C4=CC=CC=C4

DOS

IR

Vibrations