Geometry & MOs

Info

ID:	353392
PubChem CID:	127284768
Reduced:	SO2N4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	345.151098
ΔH_f, kcal/mol:	-11.58
Dipole, Da:	5.45
IP(EA), eV:	-9.09(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN(C2CCSC2)C(=O)C3=CC=C(C=C3)N4C=NN=C4

DOS

IR

Vibrations