Geometry & MOs

Info

ID:	265525
PubChem CID:	103528187
Reduced:	NOBr2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	223.100857
ΔH_f, kcal/mol:	-16.2
Dipole, Da:	5.13
IP(EA), eV:	-9.67(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-hydroxy-N-(3-methylbut-2-enyl)benzamide

Drug info:

PubChemData

Smile

CC(=CCNC(=O)C1=C(C=C(C=C1)Br)Br)C

DOS

IR

Vibrations