Geometry & MOs

Info

ID:	370291
PubChem CID:	127337962
Reduced:	ON6C19H32 (1)
Stoich.:	AB6C19D32 (1)
Weight, g/mol:	359.177982
ΔH_f, kcal/mol:	-24.32
Dipole, Da:	6.22
IP(EA), eV:	-8.48(-0.08)
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-[(3-methylthiophen-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)N3CCN(CC3)CC(C)C

DOS

IR

Vibrations