Geometry & MOs

Info

ID:	356538
PubChem CID:	127291760
Reduced:	O4N5C17H23 (1)
Stoich.:	A4B5C17D23 (1)
Weight, g/mol:	369.172228
ΔH_f, kcal/mol:	-135.9
Dipole, Da:	1.9
IP(EA), eV:	-9.21(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfonyl-1-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)CN3C=CC(=O)N(C3=O)C)C

DOS

IR

Vibrations