Geometry & MOs

Info

ID:	53506
PubChem CID:	14716391
Reduced:	NO2H16C17 (2)
Stoich.:	AB2C16D17 (2)
Weight, g/mol:	548.231122
ΔH_f, kcal/mol:	-69.18
Dipole, Da:	5.61
IP(EA), eV:	-8.39(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2'-(4-acetylanilino)-6'-[2-ethoxyethyl(methyl)amino]-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one

Drug info:

PubChemData

Smile

CCN(CC1CCOC1)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=C(O3)C=C(C(=C6)NC7=CC=CC=C7)C

DOS

IR

Vibrations