Geometry & MOs

Info

ID:	358436
PubChem CID:	127296004
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	336.190989
ΔH_f, kcal/mol:	-128.41
Dipole, Da:	6.28
IP(EA), eV:	-8.73(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-3-(2-imidazol-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCCC1)N2CCN(CC2)C(=O)NC3CCCCC3

DOS

IR

Vibrations