Geometry & MOs

Info

ID:	170290
PubChem CID:	75214672
Reduced:	N3O8C33H49 (1)
Stoich.:	A3B8C33D49 (1)
Weight, g/mol:	435.131802
ΔH_f, kcal/mol:	-332.85
Dipole, Da:	5.19
IP(EA), eV:	-9.34(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-acetyl-N-benzyl-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxodibenzofuran-4-carboxamide

Drug info:

PubChemData

Smile

CC1(C(=O)NC(C1(CCCCCC2=NOC(=C2)CNC(=O)C(C)(C)C(CCCCC3=CC=CC=C3)O)O)(CO)C(=O)OC)C

DOS

IR

Vibrations