Geometry & MOs

Info

ID:	375253
PubChem CID:	131481083
Reduced:	NC14H23 (1)
Stoich.:	AB14C23 (1)
Weight, g/mol:	261.966685
ΔH_f, kcal/mol:	-17.94
Dipole, Da:	2.31
IP(EA), eV:	-9.08(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-7-(difluoromethyl)-1-benzothiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)[C@@H](C1=CC(=CC=C1)C(C)(C)C)N

DOS

IR

Vibrations