Geometry & MOs

Info

ID:	370255
PubChem CID:	127337922
Reduced:	ClON5C21H26 (1)
Stoich.:	ABC5D21E26 (1)
Weight, g/mol:	357.252861
ΔH_f, kcal/mol:	4.41
Dipole, Da:	5.94
IP(EA), eV:	-8.51(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCCC3C4=CC=CC=C4Cl

DOS

IR

Vibrations