Geometry & MOs

Info

ID:	338363
PubChem CID:	127259055
Reduced:	O6H14C17 (1)
Stoich.:	A6B14C17 (1)
Weight, g/mol:	233.080041
ΔH_f, kcal/mol:	-200.77
Dipole, Da:	4.09
IP(EA), eV:	-9.33(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylbenzimidazol-2-yl)carbamoyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCCOC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O

DOS

IR

Vibrations