Geometry & MOs

Info

ID:	82983
PubChem CID:	49856933
Reduced:	N2O7C22H28 (1)
Stoich.:	A2B7C22D28 (1)
Weight, g/mol:	488.252252
ΔH_f, kcal/mol:	-276.1
Dipole, Da:	5.28
IP(EA), eV:	-9.35(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(9R,10R)-9-(diethylcarbamoyloxy)-2-ethyl-8,8-dimethyl-4-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] N,N-diethylcarbamate

Drug info:

PubChemData

Smile

CCC1=CC(=O)C2=C(O1)C3=C(C=C2)OC([C@@H]([C@@H]3OC(=O)N(C)C)OC(=O)N(C)C)(C)C

DOS

IR

Vibrations