Geometry & MOs

Info

ID:	81400
PubChem CID:	49854684
Reduced:	O2N4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	388.05349
ΔH_f, kcal/mol:	17.46
Dipole, Da:	7.83
IP(EA), eV:	-8.55(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-bromo-1-propan-2-ylbenzimidazol-2-yl)amino]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2C3=CC=CC=C3N=C2NC4=CC=C(C=C4)C(=O)NO

DOS

IR

Vibrations