Geometry & MOs

Info

ID:	49231
PubChem CID:	11532129
Reduced:	NO3C28H35 (1)
Stoich.:	AB3C28D35 (1)
Weight, g/mol:	433.086305
ΔH_f, kcal/mol:	-106.36
Dipole, Da:	2.55
IP(EA), eV:	-8.67(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[1-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-5-oxopyrrolidin-3-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C2CCCC2)(C(=O)OC3C4CCC3CN(C4)CC5=CC=CC=C5)O

DOS

IR

Vibrations