Geometry & MOs

Info

ID:	154034
PubChem CID:	56313398
Reduced:	FN2O2C21H23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	358.169271
ΔH_f, kcal/mol:	-70.5
Dipole, Da:	3.27
IP(EA), eV:	-8.41(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-[[2-(2-fluorophenyl)-2-methylpropyl]carbamoyl]-2-methylpyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CN1C=CC2=C1C=CC(=C2)OC)C3=CC=CC=C3F

DOS

IR

Vibrations