Geometry & MOs

Info

ID:	346518
PubChem CID:	127271022
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	328.189926
ΔH_f, kcal/mol:	33.53
Dipole, Da:	5.48
IP(EA), eV:	-9.04(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[1-(5-methyl-1H-indazole-7-carbonyl)piperidin-3-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)N3CCN(CC3)CC4=NC(=NO4)C)NN=C2

DOS

IR

Vibrations