Geometry & MOs

Info

ID:	378978
PubChem CID:	134228735
Reduced:	ClN4H13C14 (1)
Stoich.:	AB4C13D14 (1)
Weight, g/mol:	232.137577
ΔH_f, kcal/mol:	86.05
Dipole, Da:	2.17
IP(EA), eV:	-8.93(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-4-fluoro-2-methyl-6-propan-2-ylbenzimidazole

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=CC(=C2)C3=NC(=NC=C3)Cl)C=N1

DOS

IR

Vibrations