Geometry & MOs

Info

ID:	358257
PubChem CID:	127295802
Reduced:	SN3O4C13H25 (1)
Stoich.:	AB3C4D13E25 (1)
Weight, g/mol:	339.136511
ΔH_f, kcal/mol:	-182.15
Dipole, Da:	7.16
IP(EA), eV:	-9.13(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-3-(1,3-thiazol-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)NCCN2CCCS2(=O)=O

DOS

IR

Vibrations