Geometry & MOs

Info

ID:	362365
PubChem CID:	127307456
Reduced:	O2N5C20H37 (1)
Stoich.:	A2B5C20D37 (1)
Weight, g/mol:	393.219846
ΔH_f, kcal/mol:	-124.22
Dipole, Da:	5.39
IP(EA), eV:	-8.44(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-[(5-methylthiophene-2-carbonyl)amino]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)N2CCC(CC2)NC(=O)CC3CCCC3)C

DOS

IR

Vibrations