Geometry & MOs

Info

ID:	370239
PubChem CID:	127337906
Reduced:	OSN5C19H25 (1)
Stoich.:	ABC5D19E25 (1)
Weight, g/mol:	359.177982
ΔH_f, kcal/mol:	19.05
Dipole, Da:	6.33
IP(EA), eV:	-8.53(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCCC3C4=CSC=C4

DOS

IR

Vibrations