Geometry & MOs

Info

ID:	242327
PubChem CID:	96099859
Reduced:	O3N4C16H20 (1)
Stoich.:	A3B4C16D20 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-55.1
Dipole, Da:	1.59
IP(EA), eV:	-9.02(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[5,6-dimethoxy-2-(methylaminomethyl)benzimidazol-1-yl]propanoic acid

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)[C@@H]2CCCN2C(=O)CN3C=CC=CC3=O

DOS

IR

Vibrations