Geometry & MOs

Info

ID:	266108
PubChem CID:	103558415
Reduced:	OSN3C8H13 (1)
Stoich.:	ABC3D8E13 (1)
Weight, g/mol:	241.121512
ΔH_f, kcal/mol:	1.82
Dipole, Da:	2.32
IP(EA), eV:	-8.96(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-methoxycyclobutyl)methyl]-3H-benzimidazole-5-carbonitrile

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NC(=NS2)N

DOS

IR

Vibrations