Geometry & MOs

Info

ID:	351727
PubChem CID:	127282127
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-67.14
Dipole, Da:	4.21
IP(EA), eV:	-9.15(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(6-methylpyridine-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)CCN3C=CC=N3

DOS

IR

Vibrations