Geometry & MOs

Info

ID:	265972
PubChem CID:	103557158
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-81.18
Dipole, Da:	4.62
IP(EA), eV:	-9.61(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-methoxycyclobutyl)methyl]-1-methylbenzimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NC3=C(N2)C=C(C=C3)C(=O)O

DOS

IR

Vibrations