Geometry & MOs

Info

ID:	370136
PubChem CID:	127337507
Reduced:	ON6C20H34 (1)
Stoich.:	AB6C20D34 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	-19.01
Dipole, Da:	6.49
IP(EA), eV:	-8.27(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(4-propylcyclohexyl)-1-(1-pyridazin-3-ylpiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC(C)NC(=O)N(C)C2CCCN(C2)C3=NN=CC=C3

DOS

IR

Vibrations