Geometry & MOs

Info

ID:	267991
PubChem CID:	103593571
Reduced:	ClFON2C16H20 (1)
Stoich.:	ABCD2E16F20 (1)
Weight, g/mol:	297.140804
ΔH_f, kcal/mol:	-85.49
Dipole, Da:	6.85
IP(EA), eV:	-8.84(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1-chloroethyl)-5-fluoro-6-methylbenzimidazol-1-yl]-N,N-dimethylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)N=C(N2CCC3CCCO3)C(C)Cl

DOS

IR

Vibrations