Geometry & MOs

Info

ID:	63855
PubChem CID:	26759330
Reduced:	N2F3O4H19C20 (1)
Stoich.:	A2B3C4D19E20 (1)
Weight, g/mol:	400.031827
ΔH_f, kcal/mol:	-296.34
Dipole, Da:	4.95
IP(EA), eV:	-9.88(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NCC1=CC=CC=C1)OC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations