Geometry & MOs

Info

ID:	287014
PubChem CID:	104231693
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	268.121178
ΔH_f, kcal/mol:	-4.34
Dipole, Da:	3.33
IP(EA), eV:	-8.82(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(2-indazol-1-yl-6-methoxyphenyl)ethanol

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=CC=C1OC)N2C3=CC=CC=C3C=N2)O

DOS

IR

Vibrations