Geometry & MOs

Info

ID:	266111
PubChem CID:	103558428
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	19.77
Dipole, Da:	1.7
IP(EA), eV:	-8.77(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(1-methoxycyclobutyl)methyl]-1-methylbenzimidazol-4-yl]methanamine

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NC3=C(N2C4CC4)C=CC(=C3)CN

DOS

IR

Vibrations