Geometry & MOs

Info

ID:	348184
PubChem CID:	127273246
Reduced:	ClO2N3C20H26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	379.237211
ΔH_f, kcal/mol:	-63.06
Dipole, Da:	4.99
IP(EA), eV:	-9.34(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)NCC2(CCC2)C3=CC=C(C=C3)Cl)C(=O)NC4CC4

DOS

IR

Vibrations