Geometry & MOs

Info

ID:	374488
PubChem CID:	131330367
Reduced:	FNO2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	216.051047
ΔH_f, kcal/mol:	-118.64
Dipole, Da:	3.15
IP(EA), eV:	-8.94(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(trifluoromethyl)-1H-benzimidazol-5-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)[C@H]2COCCN2)O

DOS

IR

Vibrations