Geometry & MOs

Info

ID:	200394
PubChem CID:	79381642
Reduced:	SN2O3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	307.208219
ΔH_f, kcal/mol:	-43.21
Dipole, Da:	3.47
IP(EA), eV:	-9.36(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(2,4-dimethylpiperidin-1-yl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

C1CC1NC(=O)CCCNC(=O)C2=C(C=CS2)C#CCO

DOS

IR

Vibrations