Geometry & MOs

Info

ID:	191438
PubChem CID:	78146201
Reduced:	BrN3O3F6H6C8 (1)
Stoich.:	AB3C3D6E6F8 (1)
Weight, g/mol:	320.020731
ΔH_f, kcal/mol:	-435.15
Dipole, Da:	0.92
IP(EA), eV:	-10.86(-2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(ethylideneamino) N-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1C(C(=O)NC(=O)N1)NC(=O)C(C(F)(F)F)(C(F)(F)F)Br

DOS

IR

Vibrations