Geometry & MOs

Info

ID:	345711
PubChem CID:	127270011
Reduced:	O2N4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	351.138305
ΔH_f, kcal/mol:	-12.2
Dipole, Da:	2.58
IP(EA), eV:	-8.47(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-(4-fluorospiro[2H-indole-3,1'-cyclobutane]-1-yl)methanone

Drug info:

PubChemData

Smile

C1CC2CC(CC(C1)C2=O)C(=O)NC3=CC=C(C=C3)C4=NNC(=N4)C5CC5

DOS

IR

Vibrations