Geometry & MOs

Info

ID:	361034
PubChem CID:	127301918
Reduced:	O3N4C16H28 (1)
Stoich.:	A3B4C16D28 (1)
Weight, g/mol:	365.152161
ΔH_f, kcal/mol:	-165.03
Dipole, Da:	2.49
IP(EA), eV:	-8.7(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-2-oxoethyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CC(C)NC(=O)CN2CCC(=O)NC2=O)C

DOS

IR

Vibrations