Geometry & MOs

Info

ID:	357073
PubChem CID:	127293142
Reduced:	SN3O3C20H29 (1)
Stoich.:	AB3C3D20E29 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-127.92
Dipole, Da:	2.93
IP(EA), eV:	-8.75(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations