Geometry & MOs

Info

ID:	367526
PubChem CID:	127324886
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	379.135448
ΔH_f, kcal/mol:	-113.11
Dipole, Da:	2.84
IP(EA), eV:	-8.7(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)N1CCSCC1C2=CC=CC=C2)N3C(=O)C4(CCCC4)NC3=O

DOS

IR

Vibrations