Geometry & MOs

Info

ID:	273008
PubChem CID:	103770310
Reduced:	BrClNF2O2H9C10 (1)
Stoich.:	ABCD2E2F9G10 (1)
Weight, g/mol:	205.091435
ΔH_f, kcal/mol:	-173.8
Dipole, Da:	4.97
IP(EA), eV:	-10.06(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)hexa-2,4-dienamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)C(=O)NCC(C(F)F)O)Cl

DOS

IR

Vibrations