Geometry & MOs

Info

ID:	375232
PubChem CID:	131480992
Reduced:	NF4H9C10 (1)
Stoich.:	AB4C9D10 (1)
Weight, g/mol:	208.084792
ΔH_f, kcal/mol:	-190.67
Dipole, Da:	2.39
IP(EA), eV:	-9.49(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nitro-2-[(2S)-pyrrolidin-2-yl]phenol

Drug info:

PubChemData

Smile

C1[C@H](NCC2=C1C=C(C=C2)F)C(F)(F)F

DOS

IR

Vibrations