Geometry & MOs

Info

ID:	345886
PubChem CID:	127270186
Reduced:	SN2O3C16H26 (1)
Stoich.:	AB2C3D16E26 (1)
Weight, g/mol:	379.180839
ΔH_f, kcal/mol:	-157.56
Dipole, Da:	4.66
IP(EA), eV:	-8.9(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluorospiro[2H-indole-3,1'-cyclobutane]-1-yl)-[3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazol-5-yl]methanone

Drug info:

PubChemData

Smile

C1CC(CCC1C(=O)N2CCSCC2)NC(=O)C3CCOC3

DOS

IR

Vibrations