Geometry & MOs

Info

ID:	229737
PubChem CID:	87568736
Reduced:	FSO2N6C19H19 (1)
Stoich.:	ABC2D6E19F19 (1)
Weight, g/mol:	480.146741
ΔH_f, kcal/mol:	-14.99
Dipole, Da:	6.86
IP(EA), eV:	-9.12(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[1-[[6-[(7-methyl-[1,3]thiazolo[4,5-b]pyridin-2-yl)oxy]-1-benzofuran-3-yl]methyl]piperidin-4-yl]amino]-2-oxoethyl] formate

Drug info:

PubChemData

Smile

CC(=S)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3C=C(N=C3)CN4C=CC=N4)F

DOS

IR

Vibrations