Geometry & MOs

Info

ID:	447723
PubChem CID:	135285119
Reduced:	FO4N5H26C27 (1)
Stoich.:	AB4C5D26E27 (1)
Weight, g/mol:	382.01285
ΔH_f, kcal/mol:	-93.78
Dipole, Da:	5.32
IP(EA), eV:	-8.97(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-methylindazol-3-yl)-[2-(difluoromethoxy)phenyl]methanol

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C2=C(O1)C(=CC=C2)F)CC3=C4C=C(C=CC4=NN3C)C5=CN=C(N=C5)C6(CC(C6)(C)O)O

DOS

IR

Vibrations