Geometry & MOs

Info

ID:	362326
PubChem CID:	127307355
Reduced:	O2N5C17H33 (1)
Stoich.:	A2B5C17D33 (1)
Weight, g/mol:	298.236876
ΔH_f, kcal/mol:	-111.77
Dipole, Da:	3.04
IP(EA), eV:	-8.44(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,4-dimethylpiperazin-2-yl)methyl]-3-[1-(oxolan-2-yl)propan-2-yl]urea

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)NCC2CN(CCN2C)C

DOS

IR

Vibrations