Geometry & MOs

Info

ID:	37072
PubChem CID:	8016515
Reduced:	N2O6C22H25 (1)
Stoich.:	A2B6C22D25 (1)
Weight, g/mol:	362.126657
ΔH_f, kcal/mol:	-150.51
Dipole, Da:	5.89
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.872472
Charge, e:	0

Chem-info

IUPAC name:

N-pyridin-2-yl-2-(2,3,5-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@@H]2C3=CC(=C(C=C3CCN2C(=O)NCCC(=O)[O-])OC)OC

DOS

IR

Vibrations