Geometry & MOs

Info

ID:	372127
PubChem CID:	131293505
Reduced:	ON2F4C8H8 (1)
Stoich.:	AB2C4D8E8 (1)
Weight, g/mol:	229.06697
ΔH_f, kcal/mol:	-208.14
Dipole, Da:	2.05
IP(EA), eV:	-10.1(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(R)-amino(cyclobutyl)methyl]-3-chloro-6-fluorophenol

Drug info:

PubChemData

Smile

C1=C(C=NC(=C1F)[C@H](C(CO)(F)F)N)F

DOS

IR

Vibrations