Geometry & MOs

Info

ID:	355074
PubChem CID:	127287935
Reduced:	N3O4C17H21 (1)
Stoich.:	A3B4C17D21 (1)
Weight, g/mol:	238.131742
ΔH_f, kcal/mol:	-154.06
Dipole, Da:	4.16
IP(EA), eV:	-9.22(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carbonyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)[C@H]2CCC(=O)N2)C(=O)N3CCOCC3

DOS

IR

Vibrations