Geometry & MOs

Info

ID:	78144
PubChem CID:	49681720
Reduced:	SO2N3C21H27 (1)
Stoich.:	AB2C3D21E27 (1)
Weight, g/mol:	385.182398
ΔH_f, kcal/mol:	-40.84
Dipole, Da:	1.34
IP(EA), eV:	-8.87(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)C(=O)NCCC2=CC=CC=C2)CC3=CSC=C3

DOS

IR

Vibrations