Geometry & MOs

Info

ID:	272338
PubChem CID:	103739999
Reduced:	F2N2O3C12H14 (1)
Stoich.:	A2B2C3D12E14 (1)
Weight, g/mol:	298.112899
ΔH_f, kcal/mol:	-135.68
Dipole, Da:	5.42
IP(EA), eV:	-10.21(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-2,6-difluoro-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C1=C(C=CC(=C1F)[N+](=O)[O-])F

DOS

IR

Vibrations