Geometry & MOs

Info

ID:	78127
PubChem CID:	49681699
Reduced:	SO2N3C17H27 (1)
Stoich.:	AB2C3D17E27 (1)
Weight, g/mol:	337.182398
ΔH_f, kcal/mol:	-88.2
Dipole, Da:	2.4
IP(EA), eV:	-8.76(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methylpropyl)-N-[[1-(thiophen-3-ylmethyl)piperidin-4-yl]methyl]oxamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(=O)NCC1CCN(CC1)CC2=CSC=C2

DOS

IR

Vibrations