Geometry & MOs

Info

ID:	372111
PubChem CID:	131293304
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	205.090292
ΔH_f, kcal/mol:	65.81
Dipole, Da:	2.53
IP(EA), eV:	-9.0(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-fluoro-5-hydroxy-2-methylphenyl)cyclopropyl]acetonitrile

Drug info:

PubChemData

Smile

CC1=CN(N=C1C2=NC(=NC(=C2)CN)C)C

DOS

IR

Vibrations