Geometry & MOs

Info

ID:	274193
PubChem CID:	103807663
Reduced:	N2O2F3C12H21 (1)
Stoich.:	A2B2C3D12E21 (1)
Weight, g/mol:	395.93296
ΔH_f, kcal/mol:	-265.39
Dipole, Da:	3.43
IP(EA), eV:	-9.18(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-aminocyclohexyl)-2,5-dibromo-N-methylthiophene-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCC(CC1)N)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations