Geometry & MOs

Info

ID:	273847
PubChem CID:	103805358
Reduced:	ON2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	253.124883
ΔH_f, kcal/mol:	-59.83
Dipole, Da:	5.7
IP(EA), eV:	-9.22(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(aminomethyl)piperidin-1-yl]-(2,4-dimethyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

C1CC(C1)CC(=O)N2CCC(CC2)CN

DOS

IR

Vibrations