Geometry & MOs

Info

ID:	367507
PubChem CID:	127324839
Reduced:	O2N6C17H28 (1)
Stoich.:	A2B6C17D28 (1)
Weight, g/mol:	365.188546
ΔH_f, kcal/mol:	-47.65
Dipole, Da:	3.45
IP(EA), eV:	-8.67(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-3-(4,5-dimethyl-1,3-thiazol-2-yl)urea

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)NC(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations