Geometry & MOs

Info

ID:	370235
PubChem CID:	127337902
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	387.182588
ΔH_f, kcal/mol:	-50.47
Dipole, Da:	4.76
IP(EA), eV:	-8.5(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3-chlorophenyl)ethyl]-1-methyl-3-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCOC4C3CCC4

DOS

IR

Vibrations