Geometry & MOs

Info

ID:	446499
PubChem CID:	135275488
Reduced:	NO3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	380.162374
ΔH_f, kcal/mol:	-160.17
Dipole, Da:	2.77
IP(EA), eV:	-8.42(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[hydroxy-[(10-methoxyanthracen-9-yl)methoxy]methyl]oxepan-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CCC1CCC(=O)/C(=C/N(C)C)/C1

DOS

IR

Vibrations