Geometry & MOs

Info

ID:	363060
PubChem CID:	127310091
Reduced:	SF3O4N5C13H18 (1)
Stoich.:	AB3C4D5E13F18 (1)
Weight, g/mol:	357.09364
ΔH_f, kcal/mol:	-298.95
Dipole, Da:	7.14
IP(EA), eV:	-9.87(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-4H-1,4-benzoxazine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)NC2CCN(C2=O)CC(F)(F)F

DOS

IR

Vibrations