Geometry & MOs

Info

ID:	372894
PubChem CID:	131306644
Reduced:	N2F3C7H15 (1)
Stoich.:	A2B3C7D15 (1)
Weight, g/mol:	315.97087
ΔH_f, kcal/mol:	-172.2
Dipole, Da:	3.22
IP(EA), eV:	-8.97(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(5-iodo-1H-benzimidazol-4-yl)acetate

Drug info:

PubChemData

Smile

CC(C)(C(C(F)(F)F)N)N(C)C

DOS

IR

Vibrations