Geometry & MOs

Info

ID:	157320
PubChem CID:	56422877
Reduced:	S2O3N4C17H28 (1)
Stoich.:	A2B3C4D17E28 (1)
Weight, g/mol:	390.132805
ΔH_f, kcal/mol:	-113.08
Dipole, Da:	5.22
IP(EA), eV:	-8.76(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-phenyl-1,2-oxazol-5-yl)methyl 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

COC(=O)CSCCC(=O)NCCCC1=NN=C(N1C2CCCC2)SC

DOS

IR

Vibrations