Geometry & MOs

Info

ID:	363304
PubChem CID:	127310721
Reduced:	SO2N3C19H29 (1)
Stoich.:	AB2C3D19E29 (1)
Weight, g/mol:	395.17012
ΔH_f, kcal/mol:	-51.39
Dipole, Da:	2.87
IP(EA), eV:	-8.42(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(acetamidomethyl)-N-[(1-thiomorpholin-4-ylcyclohexyl)methyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)C2=NOC3=C2CCCC3)N4CCSCC4

DOS

IR

Vibrations