Geometry & MOs

Info

ID:	276365
PubChem CID:	103822517
Reduced:	N2O4C17H18 (1)
Stoich.:	A2B4C17D18 (1)
Weight, g/mol:	258.00039
ΔH_f, kcal/mol:	-116.36
Dipole, Da:	5.84
IP(EA), eV:	-9.98(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2-hydroxypropyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NC=C1)C(C(=O)O)N(C)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations