Geometry & MOs

Info

ID:	370058
PubChem CID:	127337310
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	379.237211
ΔH_f, kcal/mol:	33.3
Dipole, Da:	6.37
IP(EA), eV:	-8.7(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C2CC2)NC(=O)N(C)C3CCCN(C3)C4=NN=CC=C4

DOS

IR

Vibrations