Geometry & MOs

Info

ID:	273006
PubChem CID:	103770304
Reduced:	NCl2F2O2H11C12 (1)
Stoich.:	AB2C2D2E11F12 (1)
Weight, g/mol:	229.091435
ΔH_f, kcal/mol:	-174.38
Dipole, Da:	5.29
IP(EA), eV:	-9.82(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-4-methylbenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)/C=C/C(=O)NCC(C(F)F)O

DOS

IR

Vibrations