Geometry & MOs

Info

ID:	273063
PubChem CID:	103770420
Reduced:	NF2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	275.052463
ΔH_f, kcal/mol:	-186.39
Dipole, Da:	6.07
IP(EA), eV:	-9.59(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chlorophenyl)-N-(3,3-difluoro-2-hydroxypropyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NCC(C(F)F)O)C

DOS

IR

Vibrations