Geometry & MOs

Info

ID:	82986
PubChem CID:	49856943
Reduced:	ClON3H8C9 (1)
Stoich.:	ABC3D8E9 (1)
Weight, g/mol:	302.01537
ΔH_f, kcal/mol:	11.46
Dipole, Da:	1.64
IP(EA), eV:	-9.67(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-7-methoxy-2,2-dimethyl-3,4-dihydrochromene-4,8-diol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1Cl)N=NN(C2=O)C

DOS

IR

Vibrations