Geometry & MOs

Info

ID:	1380
PubChem CID:	4271
Reduced:	NO7C23H31 (1)
Stoich.:	AB7C23D31 (1)
Weight, g/mol:	433.210052
ΔH_f, kcal/mol:	-282.64
Dipole, Da:	8.29
IP(EA), eV:	-8.86(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-ylethyl 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate

Drug info:

PubChemData

Smile

CC1=C2COC(=O)C2=C(C(=C1OC)CC=C(C)CCC(=O)OCCN3CCOCC3)O

DOS

IR

Vibrations