Geometry & MOs

Info

ID:	361135
PubChem CID:	127302079
Reduced:	SO2N3C22H27 (1)
Stoich.:	AB2C3D22E27 (1)
Weight, g/mol:	342.205576
ΔH_f, kcal/mol:	-63.28
Dipole, Da:	3.58
IP(EA), eV:	-8.77(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-piperidin-1-yloxan-4-yl)methyl]-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)NCCC3=NC(=CS3)C4CCCCC4

DOS

IR

Vibrations