Geometry & MOs

Info

ID:	362282
PubChem CID:	127307301
Reduced:	ON5C16H27 (1)
Stoich.:	AB5C16D27 (1)
Weight, g/mol:	323.268511
ΔH_f, kcal/mol:	1.53
Dipole, Da:	1.88
IP(EA), eV:	-8.78(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclopropylmethyl)piperidin-4-yl]-3-[(1,4-dimethylpiperazin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CN(CCN1C=CC=N1)C(=O)NC2CCN(CC2)CC3CC3

DOS

IR

Vibrations