Geometry & MOs

Info

ID:	288009
PubChem CID:	104307212
Reduced:	ClNOSBr2H12C14 (1)
Stoich.:	ABCDE2F12G14 (1)
Weight, g/mol:	302.118591
ΔH_f, kcal/mol:	0.75
Dipole, Da:	4.2
IP(EA), eV:	-9.14(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-chloropropyl)phenyl]-2,6-dimethylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC(=O)C2=CC(=C(S2)Br)Br)CCCCl

DOS

IR

Vibrations