Geometry & MOs

Info

ID:	75394
PubChem CID:	48423417
Reduced:	ON2C9H14 (2)
Stoich.:	AB2C9D14 (2)
Weight, g/mol:	323.166748
ΔH_f, kcal/mol:	-50.41
Dipole, Da:	4.55
IP(EA), eV:	-9.32(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC1C2=NN=C3N2CCCCC3)OCC4CC4

DOS

IR

Vibrations