Geometry & MOs

Info

ID:	259291
PubChem CID:	103163082
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	-60.24
Dipole, Da:	4.52
IP(EA), eV:	-8.93(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-amino-2-cyclobutylethyl)-1,3-dimethylbenzimidazol-2-one

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(CC3CCC3)N)OC1=O

DOS

IR

Vibrations