Geometry & MOs

Info

ID:	279793
PubChem CID:	103845206
Reduced:	ClFN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	312.08373
ΔH_f, kcal/mol:	-6.92
Dipole, Da:	3.28
IP(EA), eV:	-8.68(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-bromo-4-methylphenyl)methylamino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)NCC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations