Geometry & MOs

Info

ID:	159501
PubChem CID:	57288267
Reduced:	SN3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	151.1361
ΔH_f, kcal/mol:	37.42
Dipole, Da:	3.66
IP(EA), eV:	-8.28(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-9-azatricyclo[4.2.1.12,5]decane

Drug info:

PubChemData

Smile

C1CCC(CC1)N2CNSC3=C2C=CN=C3

DOS

IR

Vibrations