Geometry & MOs

Info

ID:	424282
PubChem CID:	135122026
Reduced:	O4H12C17 (1)
Stoich.:	A4B12C17 (1)
Weight, g/mol:	325.077265
ΔH_f, kcal/mol:	-82.74
Dipole, Da:	2.85
IP(EA), eV:	-9.04(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-(4-phenylmethoxyphenyl)thiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)O)C2=CC(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations