Geometry & MOs

Info

ID:	78151
PubChem CID:	49681730
Reduced:	ClSO2N3C19H22 (1)
Stoich.:	ABC2D3E19F22 (1)
Weight, g/mol:	393.132254
ΔH_f, kcal/mol:	-42.26
Dipole, Da:	2.31
IP(EA), eV:	-8.87(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)C(=O)NC2=CC=C(C=C2)Cl)CC3=CSC=C3

DOS

IR

Vibrations