Geometry & MOs

Info

ID:	345618
PubChem CID:	127269918
Reduced:	O2N7C19H31 (1)
Stoich.:	A2B7C19D31 (1)
Weight, g/mol:	365.221561
ΔH_f, kcal/mol:	-57.19
Dipole, Da:	4.45
IP(EA), eV:	-8.78(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N(C)C1CCN(CC1)C(=O)NCCN2CCN(CC2)C3=NC=CC=N3

DOS

IR

Vibrations