Geometry & MOs

Info

ID:	57791
PubChem CID:	24277368
Reduced:	SN2O2H8C10 (1)
Stoich.:	AB2C2D8E10 (1)
Weight, g/mol:	277.088498
ΔH_f, kcal/mol:	-18.28
Dipole, Da:	5.0
IP(EA), eV:	-9.56(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethylamino)-6-thiophen-2-ylpyrimidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)C(=O)O)C2=CC=CS2

DOS

IR

Vibrations