Geometry & MOs

Info

ID:	447193
PubChem CID:	135281069
Reduced:	N2F3O4H9C10 (1)
Stoich.:	A2B3C4D9E10 (1)
Weight, g/mol:	357.088019
ΔH_f, kcal/mol:	-296.93
Dipole, Da:	4.66
IP(EA), eV:	-10.4(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[1-(4-chlorophenyl)pyrazol-3-yl]oxymethyl]phenyl]-methylcarbamic acid

Drug info:

PubChemData

Smile

C[C@@H](C(F)(F)F)NC(=O)C(=O)C1=CNC(=C1)C(=O)O

DOS

IR

Vibrations