Geometry & MOs

Info

ID:	157387
PubChem CID:	56423151
Reduced:	N5O5C17H19 (1)
Stoich.:	A5B5C17D19 (1)
Weight, g/mol:	467.144098
ΔH_f, kcal/mol:	-143.63
Dipole, Da:	5.91
IP(EA), eV:	-9.36(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxoethyl] 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

C=CCNC(=O)NC(=O)COC(=O)CCNC(=O)C1=NNC2=CC=CC=C21

DOS

IR

Vibrations