Geometry & MOs

Info

ID:	324301
PubChem CID:	126677379
Reduced:	N2F3O4C17H25 (1)
Stoich.:	A2B3C4D17E25 (1)
Weight, g/mol:	371.127683
ΔH_f, kcal/mol:	-192.74
Dipole, Da:	6.35
IP(EA), eV:	-9.16(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-[[6-(hydroxycarbamoyl)-3-oxo-5,6,7,8-tetrahydro-1,4-benzoxazin-4-yl]methyl]cyclohexane-1-sulfinate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1[C@@H]2CC3CC1[C@@H](C2N(C3)C(=O)CC(F)(F)F)O

DOS

IR

Vibrations