Geometry & MOs

Info

ID:	345603
PubChem CID:	127269903
Reduced:	O2N4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	383.212139
ΔH_f, kcal/mol:	-114.09
Dipole, Da:	1.59
IP(EA), eV:	-8.7(1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[cyclopentyl-(4-fluorophenyl)methyl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)NC2CCN3C2CCCC3)C

DOS

IR

Vibrations