Geometry & MOs

Info

ID:	374496
PubChem CID:	131330517
Reduced:	FNC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	242.016829
ΔH_f, kcal/mol:	-57.12
Dipole, Da:	2.76
IP(EA), eV:	-9.88(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-5-ethoxy-1-benzothiophen-2-yl)methanol

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)C(F)F)C#N)N

DOS

IR

Vibrations