Geometry & MOs

Info

ID:	28252
PubChem CID:	826552
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	277.146664
ΔH_f, kcal/mol:	-55.49
Dipole, Da:	2.32
IP(EA), eV:	-9.56(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1',3',3'-trimethylspiro[chromene-2,2'-indole]

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/1\CN2CCC1CC2)/C#N

DOS

IR

Vibrations