Geometry & MOs

Info

ID:	408608
PubChem CID:	135081375
Reduced:	AuNOPH31C35 (1)
Stoich.:	ABCDE31F35 (1)
Weight, g/mol:	251.131014
ΔH_f, kcal/mol:	137.32
Dipole, Da:	4.92
IP(EA), eV:	-7.62(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,6-dimethylphenyl)imino-1-phenylpropan-1-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)N=[C-]CC(=O)C2=CC=CC=C2.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Au+]

DOS

IR

Vibrations