Geometry & MOs

Info

ID:	276126
PubChem CID:	103820762
Reduced:	N2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	258.00039
ΔH_f, kcal/mol:	-117.11
Dipole, Da:	3.31
IP(EA), eV:	-9.25(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2S)-1-hydroxypropan-2-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CO)NC(=O)C1=CC2=C(C=C1)NC(=O)C2

DOS

IR

Vibrations