Geometry & MOs

Info

ID:	351808
PubChem CID:	127282208
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	349.182398
ΔH_f, kcal/mol:	-62.72
Dipole, Da:	6.38
IP(EA), eV:	-9.16(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(2-thiophen-3-ylacetyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations