Geometry & MOs

Info

ID:	27705
PubChem CID:	823158
Reduced:	SO2N7C11H11 (1)
Stoich.:	AB2C7D11E11 (1)
Weight, g/mol:	341.141579
ΔH_f, kcal/mol:	38.24
Dipole, Da:	5.75
IP(EA), eV:	-9.78(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-(4-ethoxyphenyl)imino-2-phenylinden-1-one

Drug info:

PubChemData

Smile

CN1C(=CC(=O)N(C1=O)C)SC2=NC=NC3=C2N=NN3C

DOS

IR

Vibrations