Geometry & MOs

Info

ID:	168399
PubChem CID:	74962345
Reduced:	O12C41H66 (1)
Stoich.:	A12B41C66 (1)
Weight, g/mol:	302.126657
ΔH_f, kcal/mol:	-606.96
Dipole, Da:	6.07
IP(EA), eV:	-9.59(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-3-(4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)OC7C(C(CC(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C

DOS

IR

Vibrations