Geometry & MOs

Info

ID:	367736
PubChem CID:	127325700
Reduced:	OSN6C16H28 (1)
Stoich.:	ABC6D16E28 (1)
Weight, g/mol:	348.195011
ΔH_f, kcal/mol:	7.7
Dipole, Da:	3.11
IP(EA), eV:	-8.72(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,5-dimethyl-N-(1-phenylpiperidin-3-yl)-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CN1CCCC(C1)CN(C)C(=O)CSC2=NN=NN2C3CCCC3

DOS

IR

Vibrations