Geometry & MOs

Info

ID:	293693
PubChem CID:	117396864
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-9.8
Dipole, Da:	4.37
IP(EA), eV:	-8.52(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(aminomethyl)cyclobutyl]-3-cyclopropyl-1H-benzimidazol-2-one

Drug info:

PubChemData

Smile

CC1=CNC(=O)N1C2=CC=CC=C2C3CCNCC3

DOS

IR

Vibrations