Geometry & MOs

Info

ID:	130103
PubChem CID:	51074934
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	241.088498
ΔH_f, kcal/mol:	-29.16
Dipole, Da:	8.38
IP(EA), eV:	-9.59(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

DOS

IR

Vibrations