Geometry & MOs

Info

ID:	356674
PubChem CID:	127292155
Reduced:	ON2C7H14 (2)
Stoich.:	AB2C7D14 (2)
Weight, g/mol:	311.268511
ΔH_f, kcal/mol:	-106.73
Dipole, Da:	2.45
IP(EA), eV:	-8.17(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-methylpiperazin-1-yl)propan-2-yl]-3-(2-piperidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C)NC(=O)NCC2CCCO2

DOS

IR

Vibrations