Geometry & MOs

Info

ID:	324484
PubChem CID:	126677745
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	298.041213
ΔH_f, kcal/mol:	43.89
Dipole, Da:	1.54
IP(EA), eV:	-7.78(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzoyl-2-sulfanylidene-1H-benzimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)N(C1=NN(C=C1)CC2=CC=CC=C2)C(C)C

DOS

IR

Vibrations