Geometry & MOs

Info

ID:	396177
PubChem CID:	135027601
Reduced:	N2O3C27H28 (1)
Stoich.:	A2B3C27D28 (1)
Weight, g/mol:	405.90271
ΔH_f, kcal/mol:	-36.19
Dipole, Da:	4.37
IP(EA), eV:	-8.51(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,6'-dibromo-2,2'-spirobi[chromene]

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)[C@@H]3[C@H]([C@@H](N(N3CC2)C(=O)C4=CC=CC=C4)CCO)C5=CC=CC=C5

DOS

IR

Vibrations