Geometry & MOs

Info

ID:	273625
PubChem CID:	103771506
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	300.04734
ΔH_f, kcal/mol:	-175.31
Dipole, Da:	2.31
IP(EA), eV:	-9.51(1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2-hydroxy-4-methylpentyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1(CCCO1)C)O

DOS

IR

Vibrations