Geometry & MOs

Info

ID:	378946
PubChem CID:	134228491
Reduced:	FO2N8C27H31 (1)
Stoich.:	AB2C8D27E31 (1)
Weight, g/mol:	206.121927
ΔH_f, kcal/mol:	15.13
Dipole, Da:	7.84
IP(EA), eV:	-8.35(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-6-fluoro-1-propan-2-ylbenzimidazole

Drug info:

PubChemData

Smile

CC1=CN2C=C(C=C(C2=N1)F)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)NC(=O)C=C)N(C)CCN(C)C)OC

DOS

IR

Vibrations