Geometry & MOs

Info

ID:	362259
PubChem CID:	127307272
Reduced:	ON5C17H35 (1)
Stoich.:	AB5C17D35 (1)
Weight, g/mol:	339.299811
ΔH_f, kcal/mol:	-66.89
Dipole, Da:	5.55
IP(EA), eV:	-8.32(1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NCC2(CCCCC2)N(C)C)C

DOS

IR

Vibrations