Geometry & MOs

Info

ID:	367287
PubChem CID:	127324064
Reduced:	SN3O3C12H23 (1)
Stoich.:	AB3C3D12E23 (1)
Weight, g/mol:	368.23246
ΔH_f, kcal/mol:	-122.92
Dipole, Da:	5.78
IP(EA), eV:	-9.48(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,3-dihydroindol-1-yl)propyl]-3-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

CN(C1CCCC1)C(=O)NCCS(=O)(=O)NC2CC2

DOS

IR

Vibrations