Geometry & MOs

Info

ID:	209765
PubChem CID:	80718186
Reduced:	BrO2N3H10C11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	-26.62
Dipole, Da:	2.53
IP(EA), eV:	-9.38(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N,3-dimethyl-N-(4-methylpentan-2-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=O)N(C=C1)CCN2C=NC=C(C2=O)Br

DOS

IR

Vibrations