Geometry & MOs

Info

ID:	372303
PubChem CID:	131296025
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	216.974212
ΔH_f, kcal/mol:	-50.72
Dipole, Da:	4.58
IP(EA), eV:	-7.79(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2,3-difluoro-4-hydroxybenzoyl cyanide

Drug info:

PubChemData

Smile

CC1=C(C(=C(N1)C2=CC=C(C=C2)O)O)CN

DOS

IR

Vibrations