Geometry & MOs

Info

ID:	362359
PubChem CID:	127307450
Reduced:	O2N5C17H33 (1)
Stoich.:	A2B5C17D33 (1)
Weight, g/mol:	284.221226
ΔH_f, kcal/mol:	-104.52
Dipole, Da:	6.3
IP(EA), eV:	-8.67(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,4-dimethylpiperazin-2-yl)methyl]-3-(oxan-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CCN(CC1)C(=O)NCC2CN(CCN2C)C

DOS

IR

Vibrations