Geometry & MOs

Info

ID:	255189
PubChem CID:	103130582
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	271.9619
ΔH_f, kcal/mol:	-19.98
Dipole, Da:	5.08
IP(EA), eV:	-8.77(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromothiophen-2-yl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(COC2=CC=CC=C2)O

DOS

IR

Vibrations