Geometry & MOs

Info

ID:	122060
PubChem CID:	50791946
Reduced:	N5O5C23H35 (1)
Stoich.:	A5B5C23D35 (1)
Weight, g/mol:	435.263425
ΔH_f, kcal/mol:	-212.85
Dipole, Da:	9.74
IP(EA), eV:	-8.02(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-diethyl-2-oxo-6-piperidin-1-ylbenzimidazol-5-yl)-3-(2,4-dimethylphenyl)urea

Drug info:

PubChemData

Smile

CCOCCCNC(=O)NC1=CC2=C(C=C1N3CCC(CC3)C(=O)OCC)N(C(=O)N2C)C

DOS

IR

Vibrations