Geometry & MOs

Info

ID:	358220
PubChem CID:	127295765
Reduced:	ON2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	331.237211
ΔH_f, kcal/mol:	-62.83
Dipole, Da:	4.05
IP(EA), eV:	-9.15(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-3-piperidin-1-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCNC(=O)N(C)CC2CCCOC2

DOS

IR

Vibrations