Geometry & MOs

Info

ID:	354968
PubChem CID:	127287829
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	374.162391
ΔH_f, kcal/mol:	-45.13
Dipole, Da:	7.07
IP(EA), eV:	-9.36(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)C(C)N3CCN(CC3)C(=O)[C@H]4CCC(=O)N4

DOS

IR

Vibrations