Geometry & MOs

Info

ID:	184367
PubChem CID:	77152123
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	370.066653
ΔH_f, kcal/mol:	0.85
Dipole, Da:	2.32
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-1,2,3a,4,5,6,7,7a-octahydroindazol-3-ylidene)-6-fluoroindole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2=CC=C(C=C2)C3CNCCO3

DOS

IR

Vibrations