Geometry & MOs

Info

ID:	285993
PubChem CID:	104144352
Reduced:	FON3C16H18 (1)
Stoich.:	ABC3D16E18 (1)
Weight, g/mol:	291.231063
ΔH_f, kcal/mol:	-55.63
Dipole, Da:	3.56
IP(EA), eV:	-8.86(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-ethyl-6-(ethylamino)-N-propylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)C)F)NC

DOS

IR

Vibrations