Geometry & MOs

Info

ID:	273244
PubChem CID:	103770753
Reduced:	SO2N3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	256.097855
ΔH_f, kcal/mol:	-66.35
Dipole, Da:	1.26
IP(EA), eV:	-8.63(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-hydroxy-4-methylpentyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CNC(=C2)C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations