Geometry & MOs

Info

ID:	242712
PubChem CID:	98461962
Reduced:	ClO3N5H22C31 (1)
Stoich.:	AB3C5D22E31 (1)
Weight, g/mol:	384.14337
ΔH_f, kcal/mol:	106.19
Dipole, Da:	4.42
IP(EA), eV:	-8.77(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(furan-2-yl)-3-methyl-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2C3=C(C=CC4=CC=CC=C43)OC5=C2C6=NC(=NN6C=N5)CO/N=C/C7=CC=CC=C7Cl

DOS

IR

Vibrations