Geometry & MOs

Info

ID:	19125
PubChem CID:	555120
Reduced:	NO4H17C19 (1)
Stoich.:	AB4C17D19 (1)
Weight, g/mol:	323.115758
ΔH_f, kcal/mol:	-109.3
Dipole, Da:	6.82
IP(EA), eV:	-9.38(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-[(N-phenylanilino)methylidene]-1,3-dioxane-4,6-dione

Drug info:

PubChemData

Smile

CC1(OC(=O)C(=CN(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O1)C

DOS

IR

Vibrations