Geometry & MOs

Info

ID:	345278
PubChem CID:	127269436
Reduced:	SN3O3C14H27 (1)
Stoich.:	AB3C3D14E27 (1)
Weight, g/mol:	369.183461
ΔH_f, kcal/mol:	-142.72
Dipole, Da:	6.29
IP(EA), eV:	-8.88(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazine-1-carbonyl]cyclopentane-1-carbonitrile

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)CN2CCS(=O)(=O)CC2

DOS

IR

Vibrations