Geometry & MOs

Info

ID:	193888
PubChem CID:	78450971
Reduced:	F2N3O5H17C19 (1)
Stoich.:	A2B3C5D17E19 (1)
Weight, g/mol:	403.093498
ΔH_f, kcal/mol:	-234.86
Dipole, Da:	1.67
IP(EA), eV:	-8.56(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)-2,6-dioxo-1,3-diazinane-5-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)N2C(=O)C(CNC2=O)C(=O)NC3=C(C=C(C=C3)F)F)OC

DOS

IR

Vibrations