Geometry & MOs

Info

ID:	323367
PubChem CID:	126674571
Reduced:	FON2H11C13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	410.96549
ΔH_f, kcal/mol:	3.23
Dipole, Da:	8.24
IP(EA), eV:	-9.53(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloroethyl N-[3-(hydroxymethyl)-2-methoxy-5-(trifluoromethoxy)phenyl]carbamate

Drug info:

PubChemData

Smile

CC1=CCCC=C1OC2=CC(=C(N=C2)C#N)F

DOS

IR

Vibrations