Geometry & MOs

Info

ID:	154581
PubChem CID:	56314047
Reduced:	FON4H23C25 (1)
Stoich.:	ABC4D23E25 (1)
Weight, g/mol:	325.147807
ΔH_f, kcal/mol:	27.63
Dipole, Da:	6.85
IP(EA), eV:	-9.1(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CN(N=C1C2=CN=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4F

DOS

IR

Vibrations