Geometry & MOs

Info

ID:	254354
PubChem CID:	103124591
Reduced:	OSN2H12C14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	254.116761
ΔH_f, kcal/mol:	49.75
Dipole, Da:	2.76
IP(EA), eV:	-8.95(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethylpyrazol-3-yl)-(1-methylindazol-3-yl)methanone

Drug info:

PubChemData

Smile

C1=CC2=C(C=NN2C=C1)C(=O)CCC3=CSC=C3

DOS

IR

Vibrations