Geometry & MOs

Info

ID:	191214
PubChem CID:	78118919
Reduced:	O3C11H15 (2)
Stoich.:	A3B11C15 (2)
Weight, g/mol:	521.133374
ΔH_f, kcal/mol:	-272.23
Dipole, Da:	7.88
IP(EA), eV:	-9.71(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3,5-difluoro-4-(trifluoromethoxy)phenoxy]piperidin-1-yl]-N-(2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazin-6-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)OC1CC2CC3(C1C4(C(CC(C(C4C(=O)C3)(C)C)O)O)C)C(=O)C2=C

DOS

IR

Vibrations