Geometry & MOs

Info

ID:	190960
PubChem CID:	78086802
Reduced:	SO2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	360.216141
ΔH_f, kcal/mol:	-27.2
Dipole, Da:	6.84
IP(EA), eV:	-8.54(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-methoxybenzoyl)piperazin-1-yl]-(3-propylpyrazolidin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2CN(CC2N(C)C)S(=O)(=O)C3=CN(C=N3)C

DOS

IR

Vibrations