Geometry & MOs

Info

ID:	449510
PubChem CID:	135299173
Reduced:	N2O3C27H28 (1)
Stoich.:	A2B3C27D28 (1)
Weight, g/mol:	385.167794
ΔH_f, kcal/mol:	-55.36
Dipole, Da:	7.43
IP(EA), eV:	-8.38(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3'-amino-5-tert-butyl-6'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one

Drug info:

PubChemData

Smile

CC(C)C1=CC2=C(C=C1)C(=O)OC23C4=C(C=C(C=C4)N(C)C)OC5=C3C=CC(=C5)N(C)C

DOS

IR

Vibrations