Geometry & MOs

Info

ID:	370032
PubChem CID:	127337249
Reduced:	N3O3C14H27 (1)
Stoich.:	A3B3C14D27 (1)
Weight, g/mol:	340.201159
ΔH_f, kcal/mol:	-161.52
Dipole, Da:	2.51
IP(EA), eV:	-8.84(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-3-(1-pyridin-2-ylethyl)urea

Drug info:

PubChemData

Smile

CN1CCC(CC1)NC(=O)NCC(C2CCOCC2)O

DOS

IR

Vibrations