Geometry & MOs

Info

ID:	192492
PubChem CID:	78275459
Reduced:	FN3O3H18C22 (1)
Stoich.:	AB3C3D18E22 (1)
Weight, g/mol:	413.07389
ΔH_f, kcal/mol:	-78.16
Dipole, Da:	3.97
IP(EA), eV:	-9.18(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-4-(4-ethylphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxamide

Drug info:

PubChemData

Smile

C=C1C(C(NC(=O)N1)C2=CC=C(O2)C3=CC=C(C=C3)F)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations