Geometry & MOs

Info

ID:	55842
PubChem CID:	17396650
Reduced:	FNO4C18H18 (1)
Stoich.:	ABC4D18E18 (1)
Weight, g/mol:	337.0717
ΔH_f, kcal/mol:	-167.69
Dipole, Da:	1.65
IP(EA), eV:	-8.51(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2,4-dimethoxyphenyl)-2,4-dimethyl-6-oxopyran-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)COC2=C(C=C(C=C2)F)C(=O)C

DOS

IR

Vibrations