Geometry & MOs

Info

ID:	364311
PubChem CID:	127315410
Reduced:	N3O3C21H37 (1)
Stoich.:	A3B3C21D37 (1)
Weight, g/mol:	371.162725
ΔH_f, kcal/mol:	-170.33
Dipole, Da:	3.02
IP(EA), eV:	-8.9(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-morpholin-4-ylsulfonylpiperazin-1-yl)-(1-propan-2-ylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCCC1OCC(=O)N2CCN(CC2)CC(=O)N3CCCCC3C

DOS

IR

Vibrations