Geometry & MOs

Info

ID:	346369
PubChem CID:	127270873
Reduced:	ON6C19H22 (1)
Stoich.:	AB6C19D22 (1)
Weight, g/mol:	307.099063
ΔH_f, kcal/mol:	48.16
Dipole, Da:	6.35
IP(EA), eV:	-8.29(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-(3-methyl-1,1-dioxothiolan-3-yl)-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)NC3=CN=C(C=C3)N4CCN(CC4)C)NN=C2

DOS

IR

Vibrations