Geometry & MOs

Info

ID:	36821
PubChem CID:	8013318
Reduced:	NO6C22H25 (1)
Stoich.:	AB6C22D25 (1)
Weight, g/mol:	386.100168
ΔH_f, kcal/mol:	-197.54
Dipole, Da:	3.41
IP(EA), eV:	-8.54(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-hydroxy-2-oxochromen-4-yl)methyl 3,4,5-trimethoxybenzoate

Drug info:

PubChemData

Smile

C[C@H]1CC2=CC=CC=C2N1C(=O)[C@@H](C)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC

DOS

IR

Vibrations