Geometry & MOs

Info

ID:	351723
PubChem CID:	127282123
Reduced:	O2N6C21H28 (1)
Stoich.:	A2B6C21D28 (1)
Weight, g/mol:	383.257277
ΔH_f, kcal/mol:	-11.99
Dipole, Da:	2.43
IP(EA), eV:	-8.77(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CN(N=N3)C4=CC=CC=C4

DOS

IR

Vibrations