Geometry & MOs

Info

ID:	153583
PubChem CID:	56312837
Reduced:	FN3O4H24C28 (1)
Stoich.:	AB3C4D24E28 (1)
Weight, g/mol:	451.123563
ΔH_f, kcal/mol:	-57.9
Dipole, Da:	6.3
IP(EA), eV:	-8.8(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[1-[3-[(4-methylphenyl)sulfamoyl]thiophene-2-carbonyl]piperidin-3-yl]carbamate

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CNC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)OCC4=CC=NC=C4

DOS

IR

Vibrations