Geometry & MOs

Info

ID:	315521
PubChem CID:	126627308
Reduced:	FN3O4C32H34 (1)
Stoich.:	AB3C4D32E34 (1)
Weight, g/mol:	199.095691
ΔH_f, kcal/mol:	-77.58
Dipole, Da:	6.22
IP(EA), eV:	-7.88(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(3S)-3-(methylamino)-2,5-dioxopyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN2C3=CC(=N2)C4=CC=CC(=C4)C5=C(C=CC(=C5)F)OCCCCOC6(CCN(C3=C1CC(=O)O)CC6)C

DOS

IR

Vibrations