Geometry & MOs

Info

ID:	226227
PubChem CID:	87350184
Reduced:	FSN4O4C17H25 (1)
Stoich.:	ABC4D4E17F25 (1)
Weight, g/mol:	496.213341
ΔH_f, kcal/mol:	-165.83
Dipole, Da:	2.17
IP(EA), eV:	-9.24(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,5-difluoro-4-[4-(1-propan-2-yloxycarbonylpiperidin-4-yl)oxyiminopiperidin-1-yl]benzoyl]-methylcarbamic acid

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2CNCCC2(C3=CC=CC=C3F)ONC(=O)N

DOS

IR

Vibrations