Geometry & MOs

Info

ID:	273051
PubChem CID:	103770391
Reduced:	NF2O3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	293.98155
ΔH_f, kcal/mol:	-190.59
Dipole, Da:	6.26
IP(EA), eV:	-9.48(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(3,3-difluoro-2-hydroxypropyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)NCC(C(F)F)O

DOS

IR

Vibrations