Geometry & MOs

Info

ID:	290205
PubChem CID:	104419067
Reduced:	NO2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	297.124405
ΔH_f, kcal/mol:	-170.98
Dipole, Da:	3.71
IP(EA), eV:	-8.72(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[3-(ethylamino)-3-oxopropyl]-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)O)O)NCCC(=O)NCCOC

DOS

IR

Vibrations