Geometry & MOs

Info

ID:	346771
PubChem CID:	127271275
Reduced:	O3N5C17H25 (1)
Stoich.:	A3B5C17D25 (1)
Weight, g/mol:	360.227374
ΔH_f, kcal/mol:	-119.8
Dipole, Da:	5.83
IP(EA), eV:	-9.31(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)NCC(=O)NC2=CN=CC=C2

DOS

IR

Vibrations