Geometry & MOs

Info

ID:	27297
PubChem CID:	820417
Reduced:	N2O2F3H15C18 (1)
Stoich.:	A2B2C3D15E18 (1)
Weight, g/mol:	238.110613
ΔH_f, kcal/mol:	-192.14
Dipole, Da:	3.2
IP(EA), eV:	-9.28(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(1H-indol-2-yl)-1-pyridin-4-ylethanol

Drug info:

PubChemData

Smile

C1[C@H](C(=O)N(C1=O)C2=CC=CC=C2)NCC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations