Geometry & MOs

Info

ID:	375246
PubChem CID:	131481065
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	206.085541
ΔH_f, kcal/mol:	-48.18
Dipole, Da:	1.26
IP(EA), eV:	-8.65(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(R)-amino(cyclopropyl)methyl]-2-fluoro-4-hydroxybenzonitrile

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C[C@@H]2CCCNC2)O

DOS

IR

Vibrations