Geometry & MOs

Info

ID:	277421
PubChem CID:	103828408
Reduced:	F2N2O3C12H14 (1)
Stoich.:	A2B2C3D12E14 (1)
Weight, g/mol:	287.108148
ΔH_f, kcal/mol:	-126.94
Dipole, Da:	8.66
IP(EA), eV:	-9.14(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,6-difluoro-4-nitroanilino)-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

C1CC(OC1)CCNC2=C(C=C(C=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations