Geometry & MOs

Info

ID:	273602
PubChem CID:	103771451
Reduced:	N2O2S2C15H20 (1)
Stoich.:	A2B2C2D15E20 (1)
Weight, g/mol:	290.058883
ΔH_f, kcal/mol:	-60.38
Dipole, Da:	2.95
IP(EA), eV:	-9.05(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-N-(2-hydroxy-4-methylpentyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CSC=C2)C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations