Geometry & MOs

Info

ID:	370227
PubChem CID:	127337894
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	289.19026
ΔH_f, kcal/mol:	-64.21
Dipole, Da:	6.54
IP(EA), eV:	-8.46(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N(C)CC3CCCOC3

DOS

IR

Vibrations