Geometry & MOs

Info

ID:	393880
PubChem CID:	135021900
Reduced:	NO6H23C25 (1)
Stoich.:	AB6C23D25 (1)
Weight, g/mol:	267.086447
ΔH_f, kcal/mol:	-176.32
Dipole, Da:	2.84
IP(EA), eV:	-9.07(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-deuterio-1-(2-deuterio-4-oxochromen-3-yl)-N-phenylmethanimine oxide

Drug info:

PubChemData

Smile

CC(C)C1=CC2=C(C=C1)OC3=C(C(N(C=C3C2=O)C4=CC=CC=C4)C(=O)OC)C(=O)OC

DOS

IR

Vibrations