Geometry & MOs

Info

ID:	329409
PubChem CID:	126736381
Reduced:	NO8C20H27 (1)
Stoich.:	AB8C20D27 (1)
Weight, g/mol:	358.132717
ΔH_f, kcal/mol:	-355.7
Dipole, Da:	2.41
IP(EA), eV:	-9.74(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(4-amino-2,3-dichlorophenyl)ethyl]-1-methyl-1-(3-methylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC(=O)OCC(=O)OCCCC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations