Geometry & MOs

Info

ID:	157073
PubChem CID:	56422092
Reduced:	SO4N5H15C18 (1)
Stoich.:	AB4C5D15E18 (1)
Weight, g/mol:	436.120526
ΔH_f, kcal/mol:	-7.24
Dipole, Da:	4.97
IP(EA), eV:	-9.27(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=NN2)C(=O)NCCC(=O)OCC3=NOC(=N3)C4=CSC=C4

DOS

IR

Vibrations