Geometry & MOs

Info

ID:	364391
PubChem CID:	127315568
Reduced:	ClSN3O3C18H24 (1)
Stoich.:	ABC3D3E18F24 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-95.73
Dipole, Da:	3.45
IP(EA), eV:	-8.76(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-[2-(dimethylamino)ethyl]-5-methyl-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCN(CC1)C(=O)C2CSCN2C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations