Geometry & MOs

Info

ID:	352966
PubChem CID:	127284057
Reduced:	O2N3C14H25 (1)
Stoich.:	A2B3C14D25 (1)
Weight, g/mol:	398.144633
ΔH_f, kcal/mol:	-103.51
Dipole, Da:	6.46
IP(EA), eV:	-9.04(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropylthiophen-2-yl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCN(CC1)C(=O)C2CCN(C2)C

DOS

IR

Vibrations