Geometry & MOs

Info

ID:	362254
PubChem CID:	127307267
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	309.252861
ΔH_f, kcal/mol:	-111.09
Dipole, Da:	5.95
IP(EA), eV:	-9.09(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(=O)N1CCCC(C1)N2CCCC2=O

DOS

IR

Vibrations