Geometry & MOs

Info

ID:	364293
PubChem CID:	127315392
Reduced:	SN2O2C8H11 (2)
Stoich.:	AB2C2D8E11 (2)
Weight, g/mol:	367.247107
ΔH_f, kcal/mol:	-101.76
Dipole, Da:	8.94
IP(EA), eV:	-9.26(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CC(C)N1C=CC(=N1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations