Geometry & MOs

Info

ID:	361050
PubChem CID:	127301940
Reduced:	SO2N3C21H33 (1)
Stoich.:	AB2C3D21E33 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-90.73
Dipole, Da:	1.07
IP(EA), eV:	-8.59(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpiperidin-2-yl)methyl]-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3

DOS

IR

Vibrations