Geometry & MOs

Info

ID:	273095
PubChem CID:	103770485
Reduced:	BrNF2O3H12C13 (1)
Stoich.:	ABC2D3E12F13 (1)
Weight, g/mol:	307.078677
ΔH_f, kcal/mol:	-190.67
Dipole, Da:	4.4
IP(EA), eV:	-9.21(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-methoxyphenyl)-N-(3,3-difluoro-2-hydroxypropyl)propanamide

Drug info:

PubChemData

Smile

C1C(=CC2=C(O1)C=CC(=C2)Br)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations