Geometry & MOs

Info

ID:	57842
PubChem CID:	24277688
Reduced:	OSN2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	306.059362
ΔH_f, kcal/mol:	-2.17
Dipole, Da:	3.24
IP(EA), eV:	-8.34(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chlorospiro[chromeno[4,3-d][1,3]thiazole-4,1'-cyclohexane]-2-amine

Drug info:

PubChemData

Smile

C1CCC2(CC1)C3=C(C4=CC=CC=C4O2)N=C(S3)N

DOS

IR

Vibrations