Geometry & MOs

Info

ID:	364312
PubChem CID:	127315411
Reduced:	SO4N5C15H25 (1)
Stoich.:	AB4C5D15E25 (1)
Weight, g/mol:	389.198442
ΔH_f, kcal/mol:	-127.99
Dipole, Da:	7.68
IP(EA), eV:	-9.18(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-(4-morpholin-4-ylsulfonylpiperazin-1-yl)butan-1-one

Drug info:

PubChemData

Smile

CC(C)N1C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations